SCHEMBL443528

SCHEMBL443528

COc1ccc2ccc(OC)cc2c1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.80
CYP1A2 P05177 2/20 0.80
RAB9A P51151 2/20 0.63
HSD17B1 P14061 1/20 0.60
HSD17B2 P37059 1/20 0.60
CA12 O43570 2/20 0.56
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
CA7 P43166 2/20 0.56
CA9 Q16790 2/20 0.56
CA14 Q9ULX7 2/20 0.56
KDM4E B2RXH2 1/20 0.56
GSTP1 P09211 1/20 0.56
NCF1 P14598 1/20 0.54
HTR1A P08908 1/20 0.53
HTR1D P28221 1/20 0.53
HTR1B P28222 1/20 0.53
CYP17A1 P05093 1/20 0.53
CYP11B2 P19099 1/20 0.53
MEN1 O00255 1/20 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
SCHEMBL29367032 1.00 CYP2A6 (0.80) CYP2A6CYP1A2RAB9AHSD17B1HSD17B2
SCHEMBL7452675 0.94 CYP1A2 (0.71) CYP2A6CYP1A2RAB9AHSD17B1HSD17B2
SCHEMBL29919511 0.94 CYP1A2 (0.71) CYP2A6CYP1A2RAB9AHSD17B1HSD17B2
SCHEMBL6891918 0.94 CYP1A2 (0.71) CYP2A6CYP1A2RAB9AHSD17B1HSD17B2
SCHEMBL7456084 0.94 CYP1A2 (0.71) CYP2A6CYP1A2RAB9AHSD17B1HSD17B2
SCHEMBL2249185 0.94 CYP1A2 (0.71) CYP2A6CYP1A2RAB9AHSD17B1HSD17B2
SCHEMBL7451812 0.94 CYP1A2 (0.71) CYP2A6CYP1A2RAB9AHSD17B1HSD17B2
SCHEMBL29447161 0.94 CYP1A2 (0.79) CYP2A6CYP1A2RAB9AHSD17B1HSD17B2
SCHEMBL443070 0.94 CYP1A2 (0.79) CYP2A6CYP1A2RAB9AHSD17B1HSD17B2
SCHEMBL22106284 0.92 CYP2A6 (0.70) CYP2A6CYP1A2RAB9AHSD17B1HSD17B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110240586-B 2,3-dihydro-1H-benzo [ f ] chroman-2-amine derivatives and their preparation 山东百极地长制药有限公司 2023-01-24 CN claimed
CN-115521193-A Industrial preparation method of 3,3',6,6' -tetramethoxy-2,2 ' -binaphthyl 陕西蒲城海泰新材料产业有限责任公司 2022-12-27 CN claimed
WO-2022023027-A1 NOVEL CHROMIUM-BASED CATALYTIC COMPOSITION AND ASSOCIATED METHOD FOR THE TRIMERISATION OF ETHYLENE TO HEXENE-1 IFP Energies Nouvelles (FR) 2022-02-03 WO claimed
CN-103880621-B The method of reducing of preparation 7-methoxy-2-tetralone Nantong Baisheng Chemical Co., Ltd. (CN) 2015-08-12 CN claimed
CN-104357045-A Synthesis method of spiropyrane small-molecule fluorescent probe with extreme acid/extreme alkaline switch response and application of spiropyrane small-molecule fluorescent probe UNIV BEIJING CHEMICAL 2015-02-18 CN claimed
CN-103880621-A Reduction method for preparing 7-methoxy-2-tetralone NANTONG BAISHENG CHEMICAL CO LTD 2014-06-25 CN claimed
EP-2123265-B1 Endipalene formulations in the treatment of psoriasis NOVAERA S R L (IT) 2012-05-23 EP claimed
CN-102076334-A Endipalene formulations in the treatment of psoriasis NOVAERA S R L 2011-05-25 CN claimed
US-20110105624-A1 ENDIPALENE FORMULATIONS IN THE TREATMENT OF PSORIASIS NOVAERA S.R L (IT) 2011-05-05 US claimed
WO-2009141694-A1 ENDIPALENE FORMULATIONS IN THE TREATMENT OF PSORIASIS NOVAERA S.R.L. (IT) 2009-11-26 WO claimed
WO-1994017985-A1 PROCESS OF MAKING MICROPOROUS PPS MEMBRANES THE DOW CHEMICAL COMPANY (US) 1994-08-18 WO claimed
EP-0606198-A1 MICROPOROUS HOLLOW FIBER OR FILM MEMBRANE OF POLY(PHENYLENE SULFIDE) (PPS) THE DOW CHEMICAL COMPANY (US) 1994-07-20 EP claimed
US-5246647-A Solvent THE DOW CHEMICAL COMPANY (US) 1993-09-21 US claimed
US-5227101-A Blending, heating, extruding or casting, quenching or coagulating and leaching a blend of unsulfonated polyether ketone copolymers and partially imcompatible polymer THE DOW CHEMICAL COMPANY (US) 1993-07-13 US claimed
US-5205968-A Process for making a microporous membrane from a blend containing a poly(etheretherketone)-type polymer, an amorphous polymer, and a solvent THE DOW CHEMICAL COMPANY (US) 1993-04-27 US claimed
WO-1993004223-A1 MICROPOROUS HOLLOW FIBER OR FILM MEMBRANE OF POLY(PHENYLENE SULFIDE) (PPS) THE DOW CHEMICAL COMPANY (US) 1993-03-04 WO claimed
EP-0286516-B1 Amino-5,6,7,8-tetrahydro-naphtho[2,3b]furan derivatives, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-03-18 EP claimed
US-5064580-A Heating, extrusion, coagulation, leaching out of plasticizer THE DOW CHEMICAL COMPANY (US) 1991-11-12 US claimed
US-5043112-A Dissolving polyphenylene sulfide in hot melted high-boiling boiling organic solvent, shaping, desolventizing, cooling THE DOW CHEMICAL COMPANY (US) 1991-08-27 US claimed
US-4904426-A MOCROPOROUS; AROMATIC RING-CONTAINING SOLVENT; EXTRUSION, QUENCHING, LEACHING, DRYING THE DOW CHEMICAL COMPANY (US) 1990-02-27 US claimed