SCHEMBL197100

SCHEMBL197100

PC(CCc1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.48
KCNH2 Q12809 3/20 0.47
SIGMAR1 Q99720 2/20 0.44
SLC6A4 P31645 3/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A3 Q01959 2/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
CASP1 P29466 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP19A1 P11511 1/20 0.42
TAAR1 Q96RJ0 2/20 0.41
ANPEP P15144 2/20 0.41
ERAP1 Q9NZ08 2/20 0.41
ERAP2 Q6P179 1/20 0.41
TDP1 Q9NUW8 2/20 0.41

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
SCHEMBL7769635 0.98 ACP3 (0.47) ACP3KCNH2SIGMAR1SLC6A4SLC6A2
Hydrochloric Acid SCHEMBL7165416 0.98 ACP3 (0.47) ACP3KCNH2SIGMAR1SLC6A4SLC6A2
SCHEMBL1398395 0.98 ACP3 (0.47) ACP3KCNH2SIGMAR1SLC6A4SLC6A2
Hydrochloric Acid SCHEMBL15412907 0.96 ACP3 (0.46) ACP3KCNH2SIGMAR1SLC6A4SLC6A2
Bromide SCHEMBL5510650 0.96 ACP3 (0.46) ACP3KCNH2SIGMAR1SLC6A4SLC6A2
SCHEMBL9132059 0.94 ACP3 (0.44) ACP3KCNH2SIGMAR1SLC6A4SLC6A2
SCHEMBL5076474 0.92 ACP3 (0.47) ACP3KCNH2SIGMAR1SLC6A4SLC6A2
SCHEMBL222542 0.92 ACP3 (0.47) ACP3KCNH2SIGMAR1SLC6A4SLC6A2
SCHEMBL197085 0.87 KCNH2 (0.50) KCNH2SIGMAR1SLC6A4SLC6A2SLC6A3
SCHEMBL15288212 0.85 SIGMAR1 (0.49) KCNH2SIGMAR1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1625136-B1 METHOD OF PREPARING 4-R-SUBSTITUTED 4-DEMETHOXYDAUNORUBICIN SOLUX CORP (US) 2016-02-24 EP claimed
US-8648000-B2 Diene polymerisation INEOS COMMERCIAL SERVICES UK LIMITED (GB) 2014-02-11 US claimed
US-8313978-B2 Organic semiconductor copolymers containing oligothiophene and n-type heteroaromatic units SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-11-20 US claimed
WO-2012035546-A3 A TAMPER EVIDENT MULTIPLE METALLIZED AND DEMETALLIZED SECURITY DEVICE AND PROCESS FOR PREPARING THE SAME KAPOOR AJAY (IN) 2012-05-10 WO claimed
EP-2083033-B1 Organic semiconducting copolymer and organic electronic device including the same SAMSUNG ELECTRONICS CO LTD (KR) 2012-04-18 EP claimed
US-20120077949-A1 Organic semiconductor copolymers containing oligothiophene and n-type heteroaromatic units LEE BANG LIN (KR) 2012-03-29 US claimed
EP-1918312-B1 Diene polymerisation INEOS COMMERCIAL SERVICES UK (GB) 2011-12-07 EP claimed
CN-1891732-B Organic semiconductor copolymers containing oligothiophene and n-type heteroaromatic units SAMSUNG ELECTRONICS CO LTD 2011-01-12 CN claimed
US-7777221-B2 Organic semiconducting copolymer and organic electronic device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-08-17 US claimed
US-20090189150-A1 Organic semiconducting copolymer and organic electronic device including the same SAMSUNG ELECTRONICS CO., LTD. 2009-07-30 US claimed
EP-1229064-B1 Process for the preparation of a polyester COUNCIL SCIENT IND RES (IN) 2004-06-02 EP claimed
EP-1229065-A1 Process for the preparation of a polyesteramide Council of Scientific and Industrial Research (IN) 2002-08-07 EP claimed
US-6410681-B1 ALTERNATING POLYESTER, POLYAMIDE UNITS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2002-06-25 US claimed
EP-0851864-B1 NOVEL COUPLING AGENTS, PROCESSES FOR THEIR PREPARATION AND HAIR DYES SCHWARZKOPF GMBH HANS (DE) 2001-05-23 EP claimed
US-5961668-A 4-(2,4-diaminophenoxymethyl)-1,3-dioxolane secondary intermediates, processes for their production, and hair colorants HANS SCHWARZKOPF GMBH & CO. KG (DE) 1999-10-05 US claimed
US-5676706-A HYDROGEN PEROXIDE-FREE HAIR COLORS; COLORFASTNESS HANS SCHWARZKOPF GMBH & CO. KG. (DE) 1997-10-14 US claimed
EP-0709365-A1 Substituted 2,4-diaminophenols, process for their preparation and hair dyes containing them Hans Schwarzkopf GmbH (DE) 1996-05-01 EP claimed
CN-1024000-C Preparation method of 4-demethoxydaunorubinone ERBA CARLO SPA (IT) 1994-03-16 CN claimed
EP-0337665-B1 PROCESS FOR PREPARING 4-DEMETHOXYDAUNOMYCINONE FARMITALIA CARLO ERBA S.r.l. (IT) 1993-02-10 EP claimed
EP-0337665-A2 Process for preparing 4-demethoxydaunomycinone FARMITALIA CARLO ERBA S.r.l. (IT) 1989-10-18 EP claimed