SCHEMBL8237259

SCHEMBL8237259

CCc1cc(C)ccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.42
SLC6A4 P31645 3/20 0.42
KCNH2 Q12809 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
IDO1 P14902 1/20 0.40
PTGS2 P35354 3/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39

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
SCHEMBL3412548 0.84 HTR2A (0.41) HTR2ASLC6A4KCNH2L3MBTL1FFAR1
SCHEMBL13806110 0.82 TAAR1 (0.41) HTR2ASLC6A4KCNH2L3MBTL1FFAR1
SCHEMBL16752294 0.81 KMT2A (0.48) HTR2ASLC6A4KCNH2L3MBTL1FFAR1
SCHEMBL8230054 0.81 GRIN2D (0.41) L3MBTL1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL13979885 0.80 SLC5A2 (0.48) HTR2ASLC6A4KCNH2FFAR1FFAR4
SCHEMBL598593 0.79 TAAR1 (0.44) L3MBTL1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6111929 0.79 PNMT (0.48) HTR2ASLC6A4KCNH2L3MBTL1FFAR1
SCHEMBL2735698 0.79 HTR2A (0.41) HTR2ASLC6A4KCNH2L3MBTL1FFAR1
SCHEMBL16998686 0.79 HTR2A (0.41) HTR2ASLC6A4KCNH2L3MBTL1FFAR1
SCHEMBL30707192 0.79 HTR2A (0.41) HTR2ASLC6A4KCNH2L3MBTL1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4140695-A Process for producing copper phthalocyanines IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1979-02-20 US claimed
US-20230399299-A1 ALDH-2 INHIBITOR COMPOUNDS AND METHODS OF USE AMYGDALA NEUROSCIENCES, INC. (US) 2023-12-14 US disclosed
US-11760762-B2 Thienopyranones and furanopyranones as kinase, bromodomain, and checkpoint inhibitors SIGNALRX PHARMACEUTICALS, INC. (US) 2023-09-19 US disclosed
US-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2023-05-04 US disclosed
US-11040954-B1 CXCR3 receptor agonists RECEPTOS LLC (US) 2021-06-22 US disclosed
US-20210145844-A1 COMBINATION THERAPY FOR NICOTINE ADDICTION AMYGDALA NEUROSCIENCES, INC. (US) 2021-05-20 US disclosed
US-20210139500-A1 COMPOUNDS TARGETING PROTEINS, COMPOSITIONS, METHODS, AND USES THEREOF BIOTHERYX, INC. (US) 2021-05-13 US disclosed
US-20190345133-A1 CXCR3 RECEPTOR AGONISTS RECEPTOS LLC 2019-11-14 US disclosed
EP-2970156-B1 SUBSTITUTED BENZOXAZOLES AND METHODS OF USE THEREOF GENENTECH INC (US) 2018-07-25 EP disclosed
WO-2018045246-A1 CXCR3 RECEPTOR AGONISTS CELGENE INTERNATIONAL II SARL (CH) 2018-03-08 WO disclosed
US-7279484-B2 Suppress tumor necrosis factor; Crohn's disease; imflammatory bowel disorders; sepsis; autoimmune disease AJINOMOTO CO., INC. (JP) 2007-10-09 US disclosed
US-7279484-B2 Suppress tumor necrosis factor; Crohn's disease; imflammatory bowel disorders; sepsis; autoimmune disease AJINOMOTO CO., INC. (JP) 2007-10-09 US disclosed
US-20070149534-A1 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-06-28 US disclosed
WO-2007071738-A1 CONDENSED HETEROCYCLIC COMPOUNDS USEFUL AS DPP-IV INHIBITORS NOVARTIS AG (CH) 2007-06-28 WO disclosed
US-7217738-B2 β2-adrenergic receptor agonists THERAVANCE, INC. (US) 2007-05-15 US disclosed
US-20070066598-A1 Compounds BIOVITRUM AB, A SWEDEN CORPORATION 2007-03-22 US disclosed
US-20070066599-A1 New compounds BIOVITRUM AB, A SWEDEN CORPORATION 2007-03-22 US disclosed
US-20070066600-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2007-03-22 US disclosed
US-4538003-A TREATMENT WITH MAGNESIUM OR ZINC ORGANOMETALLIC REAGENTS IN PRESENE OF A NICKEL BIDENTATE OR TRIDENTATE PHOSPHOROUS LIGAND E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-08-27 US disclosed
US-4140695-A Process for producing copper phthalocyanines IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1979-02-20 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 (11 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-11760762-B2 Thienopyranones and furanopyranones as kinase, bromodomain, and checkpoint inhibitors CDK1, CDKN1A, CDKL1 HTR2A 4528/4885SLC6A4 4870/4885KCNH2 3960/4885
US-20070066599-A1 New compounds SULT2A1, GPR119, STS HTR2A 1609/4885SLC6A4 513/4885KCNH2 2163/4885
US-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 IDUA, MAN2B1, GBA1 HTR2A 4216/4885SLC6A4 2477/4885KCNH2 4083/4885
US-20070066598-A1 Compounds SULT2A1, STS, SLC5A2 HTR2A 1235/4885SLC6A4 375/4885KCNH2 1884/4885
US-20210139500-A1 COMPOUNDS TARGETING PROTEINS, COMPOSITIONS, METHODS, AND USES THEREOF CKS1B, IKZF3, CKS2 HTR2A 4619/4885SLC6A4 4544/4885KCNH2 3800/4885
US-20210145844-A1 COMBINATION THERAPY FOR NICOTINE ADDICTION CHRNA2, ALDH2, ALDH1A1 HTR2A 373/4885SLC6A4 361/4885KCNH2 1314/4885
US-11040954-B1 CXCR3 receptor agonists CXCR3, CXCR1, CCR7 HTR2A 690/4885SLC6A4 2399/4885KCNH2 1654/4885
US-20190345133-A1 CXCR3 RECEPTOR AGONISTS CXCR3, CXCR1, CCR7 HTR2A 690/4885SLC6A4 2399/4885KCNH2 1654/4885
US-20070066600-A1 Compounds SULT2A1, STS, SLC5A2 HTR2A 1235/4885SLC6A4 375/4885KCNH2 1884/4885
US-20070149534-A1 PYRROLOTRIAZINE KINASE INHIBITORS NTRK2, NTRK3, NTRK1 HTR2A 1275/4885SLC6A4 1906/4885KCNH2 1482/4885
US-20230399299-A1 ALDH-2 INHIBITOR COMPOUNDS AND METHODS OF USE ALDH1A1, ALDH2, ALDH3A1 HTR2A 231/4885SLC6A4 253/4885KCNH2 3369/4885

“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.