SCHEMBL1705592

SCHEMBL1705592

CC(C)(C)c1ccncc1C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.39
ALOX5 P09917 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
CA2 P00918 3/20 0.33
CYP19A1 P11511 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA9 Q16790 2/20 0.31
CA14 Q9ULX7 1/20 0.31
LATS1 O95835 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
GAA P10253 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18235336 0.88 KIF11 (0.35) KIF11ALOX5PTGS1PTGS2CA2
SCHEMBL805458 0.86 LATS1 (0.40) KIF11ALOX5PTGS1PTGS2ALDH1A1
SCHEMBL18235334 0.86 KIF11 (0.34) KIF11ALOX5PTGS1PTGS2CA2
SCHEMBL12341054 0.86 LATS1 (0.40) KIF11ALOX5PTGS1PTGS2ALDH1A1
SCHEMBL16167559 0.86 KIF11 (0.34) KIF11ALOX5PTGS1PTGS2ALDH1A1
SCHEMBL14868405 0.83 ALDH1A1 (0.48) KIF11ALOX5PTGS1PTGS2CA2
SCHEMBL13412862 0.83 ALOX5 (0.36) KIF11ALOX5PTGS1PTGS2CA2
SCHEMBL22428716 0.82 ALOX5 (0.36) KIF11ALOX5PTGS1PTGS2CA2
SCHEMBL20576799 0.82 KIF11 (0.38) KIF11ALOX5PTGS1PTGS2ALDH1A1
SCHEMBL19367955 0.81 ALOX5 (0.32) KIF11ALOX5PTGS1PTGS2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 297 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112094300-A Dicyano tetra-tert-butyl pyridine ruthenium metal organic compound, preparation method and application thereof 荆楚理工学院 2020-12-18 CN claimed
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2024-07-16 US disclosed
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2024-07-16 US disclosed
US-20240217979-A1 GluN2 Subunit Selective Antagonists of the N-Methyl-D-Aspartate Receptors UNIV EMORY (US) 2024-07-04 US disclosed
US-20240217979-A1 GluN2 Subunit Selective Antagonists of the N-Methyl-D-Aspartate Receptors UNIV EMORY (US) 2024-07-04 US disclosed
US-12016903-B2 Long-acting growth hormone treatment ASCENDIS PHARMA ENDOCRINOLOGY DIVISION A/S (DK) 2024-06-25 US disclosed
US-20240066136-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS CULLGEN (SHANGHAI), INC. (CN) 2024-02-29 US disclosed
US-11827609-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2023-11-28 US disclosed
US-11827609-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2023-11-28 US disclosed
US-20230374024-A1 Compounds for the Treatment of Kinase-Dependent Disorders EXELIXIS, INC. 2023-11-23 US disclosed
US-20070281949-A1 Substituted pyrazolopyrimidines CEPHALON, INC. (US) 2007-12-06 US disclosed
US-7288553-B2 Indole derivatives as selective androgen receptor modulator (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-30 US disclosed
US-7282507-B2 Indole derivatives as selective androgen receptor modulators (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-16 US disclosed
US-20070149598-A1 M3 muscarinic acetylcholine receptor antagonists GLAXO GROUP LIMITED (GB) 2007-06-28 US disclosed
US-20070149598-A1 M3 muscarinic acetylcholine receptor antagonists GLAXO GROUP LIMITED (GB) 2007-06-28 US disclosed
US-20070117770-A1 Human ribosomal DNA (rDNA) and ribosomal RNA (rRNA) nucleic acids and uses thereof CYLENE PHARMACEUTICALS, INC. (US) 2007-05-24 US disclosed
US-20070043039-A1 Substituted quinobenzoxazine analogs CYLENE PHARMACEUTICALS, INC. 2007-02-22 US disclosed
US-20070032652-A1 Methods of preparing quinolone analogs SENHWA BIOSCIENCES, INC. (TW) 2007-02-08 US disclosed
US-20070015758-A1 Novel benzylamine derivatives and their utility as cholesterol ester-transfer protein inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2007-01-18 US disclosed
US-20070004677-A1 Linear urea mimics antagonists of P2Y1 receptor useful in the treatment of thrombotic condition BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 KIF11 3382/4885ALOX5 4680/4885PTGS1 2780/4885
US-12016903-B2 Long-acting growth hormone treatment GHRHR, GHSR, GHITM KIF11 768/4885ALOX5 2559/4885PTGS1 1109/4885
US-20230374024-A1 Compounds for the Treatment of Kinase-Dependent Disorders ERBB2, ERBB3, MAP3K6 KIF11 2992/4885ALOX5 3968/4885PTGS1 1457/4885
US-20070004677-A1 Linear urea mimics antagonists of P2Y1 receptor useful in the treatment of thrombotic condition P2RY1, P2RY11, UTS2R KIF11 4024/4885ALOX5 2205/4885PTGS1 391/4885
US-20240217979-A1 GluN2 Subunit Selective Antagonists of the N-Methyl-D-Aspartate Receptors GRIN2B, GRIN2A, GRIN2C KIF11 4311/4885ALOX5 2397/4885PTGS1 458/4885
US-20070043039-A1 Substituted quinobenzoxazine analogs TP53, CCNY, ACIN1 KIF11 2710/4885ALOX5 727/4885PTGS1 2017/4885
US-20240066136-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS DDB1, DCLRE1A, MDM2 KIF11 3686/4885ALOX5 4773/4885PTGS1 3614/4885
US-20070015758-A1 Novel benzylamine derivatives and their utility as cholesterol ester-transfer protein inhibitors CETP, NPC1, DBI KIF11 3959/4885ALOX5 2816/4885PTGS1 3918/4885
US-20070281949-A1 Substituted pyrazolopyrimidines DPYD, P2RX5, P2RX6 KIF11 3626/4885ALOX5 2130/4885PTGS1 900/4885
US-20070149598-A1 M3 muscarinic acetylcholine receptor antagonists CHRM3, CHRM2, CHRM5 KIF11 3070/4885ALOX5 2882/4885PTGS1 2942/4885
US-20070032652-A1 Methods of preparing quinolone analogs BAX, BAD, MCL1 KIF11 2870/4885ALOX5 793/4885PTGS1 1065/4885
US-11827609-B2 Toll like receptor modulator compounds TLR8, TLR3, TLR6 KIF11 4475/4885ALOX5 1375/4885PTGS1 211/4885
US-20070117770-A1 Human ribosomal DNA (rDNA) and ribosomal RNA (rRNA) nucleic acids and uses thereof NOP2, POLRMT, FBL KIF11 2481/4885ALOX5 4719/4885PTGS1 4452/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.