SCHEMBL4298346

SCHEMBL4298346

Cc1cc(C(C)C)c(C)o1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.48
CA1 P00915 3/20 0.37
CA9 Q16790 2/20 0.37
NQO1 P15559 1/20 0.36
MEN1 O00255 1/20 0.34
GLA P06280 1/20 0.34
CYP3A4 P08684 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 3/20 0.33
GPR55 Q9Y2T6 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
CA2 P00918 1/20 0.33
TRPA1 O75762 1/20 0.33
CHRM1 P11229 1/20 0.33
SLC6A2 P23975 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
CYP26A1 O43174 1/20 0.31
GABRA1 P14867 3/20 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
SCHEMBL12848813 0.81 CA1 (0.35) ALOX5CA1LMNAGPR55MAPT
SCHEMBL7020503 0.80 ALOX5 (0.50) ALOX5CA1CA9NQO1MEN1
SCHEMBL11844598 0.77 ALOX5 (0.47) ALOX5CA1CA9NQO1MEN1
SCHEMBL12848863 0.77 MEN1 (0.38) ALOX5CA1CA9NQO1MEN1
SCHEMBL22924946 0.77 ALOX5 (0.43) ALOX5CA1CA9NQO1MEN1
SCHEMBL178515 0.77 ALOX5 (0.43) ALOX5CA1CA9NQO1MEN1
SCHEMBL21479471 0.75 GPR55 (0.32) ALOX5CA1LMNAGPR55CA2
SCHEMBL8224149 0.72 L3MBTL1 (0.44) MEN1KMT2ALMNAMAPTCYP26A1
SCHEMBL12914095 0.72 POLB (0.36) LMNAGPR55MAPTGABRA1GABRB1
SCHEMBL26710146 0.72 ALOX5 (0.33) ALOX5CA1CA9NQO1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582712-B1 Alpha-olefins polymerization catalyst FORMOSA PLASTICS CORPORATION, U.S.A. (US) 2009-09-01 US claimed
US-20230382947-A1 METHODS FOR PROXIMITY MEDIATED COUPLING OF A FIRST AGENT TO A SECOND AGENT UNIVERSITEIT GENT (BE) 2023-11-30 US disclosed
US-20230167139-A1 PHOTOCHROMIC GERMOLE-FUSED DIARYLETHENES AND PRODUCTION THEREOF THE UNIVERSITY OF HONG KONG (CN) 2023-06-01 US disclosed
US-11634445-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-04-25 US disclosed
US-20230043959-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS INCYTE CORPORATION 2023-02-09 US disclosed
WO-2022079127-A1 METHODS FOR PROXIMITY MEDIATED COUPLING OF A FIRST AGENT TO A SECOND AGENT UNIVERSITEIT GENT (BE) 2022-04-21 WO disclosed
US-11254686-B1 Compounds and methods for modulating adenosine A2B receptor and adenosine A2A receptor CORVUS PHARMACEUTICALS, INC. (US) 2022-02-22 US disclosed
US-11178871-B2 Herbicidal pyrimidine compounds BASF SE (DE) 2021-11-23 US disclosed
US-20200399257-A1 Pesticidally Active Pyrrole Derivatives SYNGENTA PARTICIPATIONS AG (CH) 2020-12-24 US disclosed
US-20200397774-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS INCYTE HOLDINGS CORPORATION 2020-12-24 US disclosed
US-20090163592-A1 Chiral diacylhydrazine ligands for modulating the expression of exogenous genes via an ecdysone receptor complex INTREXON CORPORATION (US) 2009-06-25 US disclosed
US-7439246-B2 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-21 US disclosed
US-20080221083-A1 Heterobicyclic metalloprotease inhibitors HOCHGURTEL MATTHIAS 2008-09-11 US disclosed
US-20080221092-A1 Heterobicyclic metalloprotease inhibitors BLUHM HARALD 2008-09-11 US disclosed
US-20080221083-A1 Heterobicyclic metalloprotease inhibitors HOCHGURTEL MATTHIAS 2008-09-11 US disclosed
US-7410970-B2 Substituted 1,4,-di-piperidin-4-yl-piperazine derivatives and their use as neurokinin antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-08-12 US disclosed
US-7410970-B2 Substituted 1,4,-di-piperidin-4-yl-piperazine derivatives and their use as neurokinin antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-08-12 US disclosed
US-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant SCHERING CORPORATION 2007-06-21 US disclosed
US-20070032478-A1 Kinase Inhibitors ALLERGAN, INC. 2007-02-08 US disclosed
US-7173031-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-06 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-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant CNR2, GPR119, GLP1R ALOX5 2036/4885CA1 2920/4885CA9 2433/4885
US-11254686-B1 Compounds and methods for modulating adenosine A2B receptor and adenosine A2A receptor ADORA2A, ADORA2B, ADORA3 ALOX5 448/4885CA1 2878/4885CA9 3790/4885
US-20090163592-A1 Chiral diacylhydrazine ligands for modulating the expression of exogenous genes via an ecdysone receptor complex NR2E3, CRYZ, TCF12 ALOX5 4606/4885CA1 2422/4885CA9 4260/4885
US-20080221083-A1 Heterobicyclic metalloprotease inhibitors MMP13, MMP3, TIMP3 ALOX5 1243/4885CA1 325/4885CA9 267/4885
US-20200397774-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS JAK1, JAK2, JAK3 ALOX5 1792/4885CA1 4743/4885CA9 3279/4885
US-20230382947-A1 METHODS FOR PROXIMITY MEDIATED COUPLING OF A FIRST AGENT TO A SECOND AGENT DCLRE1A, CNBP, RNGTT ALOX5 3254/4885CA1 194/4885CA9 946/4885
US-11178871-B2 Herbicidal pyrimidine compounds DPYD, TYMP, TYMS ALOX5 1144/4885CA1 3265/4885CA9 3344/4885
US-20230167139-A1 PHOTOCHROMIC GERMOLE-FUSED DIARYLETHENES AND PRODUCTION THEREOF AGL, GMNN, GAK ALOX5 2920/4885CA1 4315/4885CA9 4454/4885
US-20200399257-A1 Pesticidally Active Pyrrole Derivatives ACHE, DDT, CAT ALOX5 348/4885CA1 2973/4885CA9 2222/4885
US-20230043959-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS JAK1, JAK2, JAK3 ALOX5 1971/4885CA1 4745/4885CA9 3497/4885
US-20080221092-A1 Heterobicyclic metalloprotease inhibitors MMP13, MMP3, TIMP3 ALOX5 1245/4885CA1 334/4885CA9 271/4885
US-11634445-B2 Organic electroluminescent materials and devices L1CAM, EPCAM, SOD1 ALOX5 3209/4885CA1 1023/4885CA9 695/4885
US-20070032478-A1 Kinase Inhibitors ABL1, LCK, ERBB2 ALOX5 4181/4885CA1 3875/4885CA9 2965/4885

“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.