SCHEMBL3296809

SCHEMBL3296809

COc1ccccc1Cc1ccccc1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.61
TAAR1 Q96RJ0 1/20 0.61
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
CA7 P43166 2/20 0.60
CA9 Q16790 2/20 0.60
CA12 O43570 1/20 0.60
CA4 P22748 1/20 0.60
CA14 Q9ULX7 1/20 0.60
CHRM2 P08172 2/20 0.59
CHRM1 P11229 1/20 0.59
ALDH1A1 P00352 1/20 0.57
GAA P10253 1/20 0.57
MAPT P10636 1/20 0.57
ATM Q13315 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
SIGMAR1 Q99720 1/20 0.53
AOC3 Q16853 1/20 0.53
CNR2 P34972 1/20 0.53
GRIN1 Q05586 3/20 0.52

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
SCHEMBL22800045 0.89 IDO1 (0.52) IDO1TAAR1CA1CA2CA7
SCHEMBL8035410 0.89 CNR2 (0.55) IDO1TAAR1CA1CA2CA7
SCHEMBL10987745 0.87 HSPA5 (0.64) IDO1TAAR1CA1CA2CHRM2
SCHEMBL8611014 0.87 IDO1 (0.50) IDO1TAAR1CA1CA2CA7
SCHEMBL3244848 0.87 IDO1 (0.50) IDO1TAAR1CA1CA2CA7
SCHEMBL24631774 0.87 IDO1 (0.55) IDO1TAAR1CA1CA2CA7
SCHEMBL1451082 0.87 TAAR1 (0.55) IDO1TAAR1CHRM2CHRM1ALDH1A1
SCHEMBL10388544 0.87 ALDH1A1 (0.59) IDO1TAAR1CA1CA2CA7
SCHEMBL5158259 0.87 IDO1 (0.50) IDO1TAAR1CA1CA2CA7
SCHEMBL28899576 0.87 IDO1 (0.50) IDO1TAAR1CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492384-B2 Imidazolylalkylcarbonyl derivatives as calcium channel modulators and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-23 US claimed
US-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-12-31 US claimed
US-4012336-A ANIONIC POLYMERIZATION CATALYSTS THE GENERAL TIRE & RUBBER COMPANY (US) 1977-03-15 US claimed
US-3965080-A Polymerization of monomers with alkaline earth metal organometallic compounds THE GENERAL TIRE & RUBBER COMPANY (US) 1976-06-22 US claimed
EP-4400520-A1 CATALYST FOR OLEFIN POLYMERIZATION AND METHOD FOR PRODUCING OLEFIN POLYMER The University of Tokyo (JP) 2024-07-17 EP disclosed
US-20230235115-A1 ESTER COMPOUND AND RESIN COMPOSITION AJINOMOTO CO., INC. (JP) 2023-07-27 US disclosed
WO-2023037849-A1 CATALYST FOR OLEFIN POLYMERIZATION AND METHOD FOR PRODUCING OLEFIN POLYMER 国立大学法人 東京大学 2023-03-16 WO disclosed
CN-108137859-A Resin additive and the masterbatch and resin combination using the resin additive 日清纺化学株式会社 2018-06-08 CN disclosed
US-8492384-B2 Imidazolylalkylcarbonyl derivatives as calcium channel modulators and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-23 US disclosed
US-8299072-B2 Pyrazolylmethylamine compounds as calcium channel modulators and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-10-30 US disclosed
US-7718337-B2 Electrophotographic photoreceptor MITSUBISHI CHEMICAL CORPORATION (JP) 2010-05-18 US disclosed
US-7718337-B2 Electrophotographic photoreceptor MITSUBISHI CHEMICAL CORPORATION (JP) 2010-05-18 US disclosed
EP-1070711-A2 Heteroaryl-substituted pyrrole derivatives, their preparation and their therapeutic uses Sankyo Company Limited (JP) 2001-01-24 EP disclosed
EP-0265017-B1 PROCESS FOR THE MUTUAL CONDENSATION OF AROMATIC AND CARBONYLIC COMPOUNDS ENIRICERCHE SPA (IT) 1992-04-01 EP disclosed
US-4895988-A ZEOLITE CATALYST ENIRICERCHE S.P.A. (IT) 1990-01-23 US disclosed
EP-0265017-A2 Process for the mutual condensation of aromatic and carbonylic compounds ENIRICERCHE S.p.A. (IT) 1988-04-27 EP disclosed
EP-0057740-A1 Pressure sensitive recording sheets DIAMOND SHAMROCK CORPORATION (US) 1982-08-18 EP disclosed
US-4012336-A ANIONIC POLYMERIZATION CATALYSTS THE GENERAL TIRE & RUBBER COMPANY (US) 1977-03-15 US disclosed
US-3966638-A POLYMERIZATION CATALYST HARGIS IVAN GLEN 1976-06-29 US disclosed
US-3965080-A Polymerization of monomers with alkaline earth metal organometallic compounds THE GENERAL TIRE & RUBBER COMPANY (US) 1976-06-22 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 (1 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-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF CACNA1B, CACNA1C, ORAI1 IDO1 2957/4885TAAR1 3270/4885CA1 1056/4885

“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.