SCHEMBL9035864

SCHEMBL9035864

CCCC[N]CCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.49
SIGMAR1 Q99720 4/20 0.48
CETP P11597 1/20 0.46
MIF P14174 2/20 0.44
TRPA1 O75762 1/20 0.44
CYP2E1 P05181 1/20 0.44
CYP2A6 P11509 1/20 0.44
HIF1A Q16665 1/20 0.44
CYP2A13 Q16696 1/20 0.44
EPAS1 Q99814 1/20 0.44
NAAA Q02083 3/20 0.43
DNM1 Q05193 1/20 0.43
HTR3A P46098 1/20 0.42
CHRM2 P08172 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42
CHRM1 P11229 1/20 0.42
DRD1 P21728 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42

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
SCHEMBL9212818 0.94 SIGMAR1 (0.52) KCNH2SIGMAR1CETPMIFNAAA
SCHEMBL9819988 0.94 SIGMAR1 (0.52) KCNH2SIGMAR1CETPMIFNAAA
SCHEMBL9819835 0.94 SIGMAR1 (0.52) KCNH2SIGMAR1CETPMIFNAAA
SCHEMBL9819895 0.92 KCNH2 (0.53) KCNH2SIGMAR1CETPMIFNAAA
SCHEMBL9819747 0.90 KCNH2 (0.56) KCNH2SIGMAR1MIFNAAAHTR2A
SCHEMBL6560088 0.87 MIF (0.47) KCNH2SIGMAR1MIFTRPA1CYP2E1
SCHEMBL9819966 0.86 KCNH2 (0.61) KCNH2SIGMAR1MIFHIF1ANAAA
SCHEMBL9819846 0.86 KCNH2 (0.61) KCNH2SIGMAR1MIFHIF1ANAAA
SCHEMBL9038087 0.86 KCNH2 (0.56) KCNH2SIGMAR1CETPMIFHIF1A
SCHEMBL10444157 0.86 KCNH2 (0.56) KCNH2SIGMAR1CETPMIFHIF1A

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0465254-B1 Fused thiophene compounds and uses thereof YOSHITOMI PHARMACEUTICAL (JP) 1996-11-13 EP disclosed
EP-0450066-B1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMA CO LTD (JP) 1996-09-11 EP disclosed
US-5401740-A FOR INHIBITING PLATELET AGGREGATION OTSUKA PHARMACEUTICAL CO. (JP) 1995-03-28 US disclosed
EP-0596125-A1 CONDENSED THIOPHENE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-05-11 EP disclosed
US-5227381-A Anticoagulant OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-13 US disclosed
US-5141930-A Antianxietic drug, antipsychotics and cardiotonic agents YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-08-25 US disclosed
EP-0465254-A1 Fused thiophene compounds and uses thereof YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-01-08 EP disclosed
EP-0450066-A1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-10-09 EP disclosed
US-4987132-A PLATELET ACTIVATING FACTOR ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-01-22 US disclosed
EP-0279681-A2 Saturated heterocyclic carboxamide derivatives YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1988-08-24 EP disclosed
US-4122261-A Polycyclic iminoisoindoline chelates STERLING DRUG INC. (US) 1978-10-24 US disclosed
US-4066653-A 1-IMINO-3-(4-IMINO-5-THIAZOLIDINYLIDENE)ISOINDOLINES STERLING DRUG INC. (US) 1978-01-03 US disclosed
US-3993658-A Thiazolidinylidene-isoindolines STERLING DRUG INC. (US) 1976-11-23 US disclosed