SCHEMBL803483

SCHEMBL803483

Cc1cc(C(C)(C)C)nc(C)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
HSD17B10 Q99714 1/20 0.36
MAPT P10636 2/20 0.35
AURKA O14965 1/20 0.35
CSF1R P07333 1/20 0.35
RET P07949 1/20 0.35
LTK P29376 1/20 0.35
CSNK1A1 P48729 1/20 0.35
CDK8 P49336 1/20 0.35
CLK2 P49760 1/20 0.35
CDK5 Q00535 1/20 0.35
ACVR1 Q04771 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 2/20 0.33
APOBEC3G Q9HC16 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL12579013 0.87 HSD17B10 (0.45) KDM4EHSD17B10HRH4
SCHEMBL24690475 0.81 HSP90AA1 (0.41) KDM4EHSP90AA1HSP90AB1HSD17B10AURKA
SCHEMBL27050468 0.81 HSP90AA1 (0.45) KDM4EHSP90AA1HSP90AB1HSD17B10MAPT
SCHEMBL12257766 0.78 KDM4E (0.39) KDM4EHSP90AA1HSP90AB1HSD17B10MAPT
SCHEMBL15256395 0.78 HSP90AA1 (0.38) KDM4EHSP90AA1HSP90AB1ALDH1A1LMNA
SCHEMBL14927263 0.78 HSP90AA1 (0.63) KDM4EHSP90AA1HSP90AB1HSD17B10MAPT
SCHEMBL24359757 0.78 HMGCR (0.36) HSP90AA1HSP90AB1MAPTLMNA
SCHEMBL2719104 0.76 HSD17B10 (0.34) KDM4EHSD17B10MAPTAURKACSF1R
SCHEMBL18701528 0.76 KDM4E (0.38) KDM4EHSP90AA1HSP90AB1HSD17B10MAPT
SCHEMBL2718887 0.76 HSD17B10 (0.42) KDM4EHSD17B10POLBNOS3NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12016852-B2 Pyrrolidine glycosidase inhibitors ASCENEURON SA (CH) 2024-06-25 US disclosed
US-11795165-B2 Tetrahydro-benzoazepine glycosidase inhibitors ASCENEURON SA (CH) 2023-10-24 US disclosed
US-11795165-B2 Tetrahydro-benzoazepine glycosidase inhibitors ASCENEURON SA (CH) 2023-10-24 US disclosed
US-11787771-B2 Hydrazide containing nuclear transport modulators and uses thereof Karyopharm Therapeutics Inc. (US) 2023-10-17 US disclosed
US-11787771-B2 Hydrazide containing nuclear transport modulators and uses thereof Karyopharm Therapeutics Inc. (US) 2023-10-17 US disclosed
US-11771677-B2 Immunomodulating urea azalides ZOETIS SERVICES LLC (US) 2023-10-03 US disclosed
US-11771677-B2 Immunomodulating urea azalides ZOETIS SERVICES LLC (US) 2023-10-03 US disclosed
US-11731972-B2 Spiro compounds as glycosidase inhibitors ASCENEURON SA (CH) 2023-08-22 US disclosed
US-11731972-B2 Spiro compounds as glycosidase inhibitors ASCENEURON SA (CH) 2023-08-22 US disclosed
US-20210290591-A1 IMMUNOMODULATING UREA AZALIDES ZOETIS SERVICES LLC 2021-09-23 US disclosed
WO-2012038081-A1 SUBSTITUTED BENZAMIDE COMPOUNDS Grünenthal GmbH (DE) 2012-03-29 WO disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US disclosed
US-20120035178-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands BRISTOL-MYERS SQUIBB COMPANY 2012-02-09 US disclosed
US-20120035189-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands BRISTOL-MYERS SQUIBB COMPANY 2012-02-09 US disclosed
US-20110135604-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2011-06-09 US disclosed
US-7863291-B2 Quinuclidine compounds as alpha-7 nicotinic acetylcholine receptor ligands BRISTOL-MYERS SQUIBB COMPANY (US) 2011-01-04 US disclosed
US-20100099684-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands BRISTOL-MYERS SQUIBB COMPANY 2010-04-22 US disclosed
US-20090270405-A1 QUINUCLIDINE COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS BRISTOL-MYERS SQUIBB COMPANY 2009-10-29 US disclosed
US-7432379-B2 Substituted pyrazole derivatives and related compounds as bradykinin B1 receptor antagonists ELAN PHARMACEUTICALS, INC. (US) 2008-10-07 US disclosed
US-7417152-B2 4-bromo-5-(2-chloro-benzoylamino)-1H-pyrazole-3-carboxylic acid amide derivatives and related compounds as bradykinin B1 receptor antagonists for the treatment of inflammatory diseases ELAN PHARMACEUTICALS, INC. (US) 2008-08-26 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 (12 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-20100099684-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands CHRNA7, CHRNA5, CHRNA6 KDM4E 3667/4885HSP90AA1 4163/4885HSP90AB1 4032/4885
US-20120035189-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands CHRNA7, CHRNA5, CHRNA6 KDM4E 3667/4885HSP90AA1 4163/4885HSP90AB1 4032/4885
US-20120035178-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands CHRNA7, CHRNA5, CHRNA6 KDM4E 3667/4885HSP90AA1 4163/4885HSP90AB1 4032/4885
US-12016852-B2 Pyrrolidine glycosidase inhibitors PREP, GAA, DNPEP KDM4E 2209/4885HSP90AA1 1984/4885HSP90AB1 780/4885
US-20090270405-A1 QUINUCLIDINE COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA7, CHRNA5, CHRNA6 KDM4E 3667/4885HSP90AA1 4163/4885HSP90AB1 4032/4885
US-20110135604-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 KDM4E 2496/4885HSP90AA1 1719/4885HSP90AB1 1671/4885
US-11787771-B2 Hydrazide containing nuclear transport modulators and uses thereof XPO1, KPNA1, ABCB11 KDM4E 1997/4885HSP90AA1 659/4885HSP90AB1 499/4885
US-11731972-B2 Spiro compounds as glycosidase inhibitors GLA, BACE1, GAA KDM4E 2919/4885HSP90AA1 1044/4885HSP90AB1 772/4885
US-11771677-B2 Immunomodulating urea azalides ARG1, IL2, CD209 KDM4E 593/4885HSP90AA1 2703/4885HSP90AB1 2799/4885
US-20210290591-A1 IMMUNOMODULATING UREA AZALIDES ARG1, IL2, CD209 KDM4E 593/4885HSP90AA1 2703/4885HSP90AB1 2799/4885
US-20120071461-A1 Substituted Benzamide Compounds BDKRB1, BDKRB2, HRH2 KDM4E 2727/4885HSP90AA1 2767/4885HSP90AB1 2082/4885
US-11795165-B2 Tetrahydro-benzoazepine glycosidase inhibitors BACE1, BACE2, BCHE KDM4E 2012/4885HSP90AA1 3335/4885HSP90AB1 2547/4885

“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.