SCHEMBL9619448

SCHEMBL9619448

CCCC(P)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.47
HRH1 P35367 5/20 0.45
HTR2A P28223 4/20 0.45
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
OPRL1 P41146 1/20 0.40
TRPA1 O75762 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
TAAR1 Q96RJ0 2/20 0.38
CHRM2 P08172 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SCN1A P35498 1/20 0.38
SCN2A Q99250 1/20 0.38
SCN3A Q9NY46 1/20 0.38
RIPK1 Q13546 1/20 0.38

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
Hydrochloric Acid SCHEMBL9619310 0.98 AOC3 (0.46) AOC3HRH1HTR2ALMNATDP1
SCHEMBL196258 0.83 HTR2A (0.45) HRH1HTR2AOPRM1OPRD1OPRK1
SCHEMBL28183730 0.83 HTR2A (0.45) HRH1HTR2AOPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL28344043 0.81 HTR2A (0.44) HRH1HTR2ATDP1OPRM1OPRD1
SCHEMBL940832 0.80 LMNA (0.52) AOC3HRH1HTR2ALMNATDP1
Hydrochloric Acid SCHEMBL9619421 0.78 LMNA (0.50) AOC3HRH1HTR2ALMNATDP1
SCHEMBL107889 0.77 HRH1 (0.56) AOC3HRH1HTR2ALMNATDP1
SCHEMBL2051666 0.76 CYP17A1 (0.49)
SCHEMBL24384344 0.76 OPRM1 (0.47) AOC3HTR2ALMNAOPRM1SLC6A4
SCHEMBL28118626 0.76 UGT2B7 (0.48) AOC3SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1058725-C Unsaturated copolymer hydrogenation method and bimetallic catalyst system used by same NANDI CHEMICAL INDUSTRY CO LTD (CN) 2000-11-22 CN claimed
CN-1199051-A Unsaturated copolymer hydrogenation method and bimetallic catalyst system used by same NANDI CHEMICAL INDUSTRY CO LTD (CN) 1998-11-18 CN claimed
EP-0249984-B1 PROCESS FOR PRODUCING BUTENE-1 POLYMER IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1992-01-08 EP claimed
CN-1111546-C Hydrogenation catalyst, preparation method thereof and application thereof in unsaturated copolymer hydrogenation NANDI CHEMICAL INDUSTRY CO LTD (CN) 2003-06-18 CN disclosed
CN-1058725-C Unsaturated copolymer hydrogenation method and bimetallic catalyst system used by same NANDI CHEMICAL INDUSTRY CO LTD (CN) 2000-11-22 CN disclosed
CN-1263111-A Hydrogenation catalyst, preparation method thereof and application thereof in unsaturated copolymer hydrogenation NANDI CHEMICAL INDUSTRY CO LTD (CN) 2000-08-16 CN disclosed
CN-1199051-A Unsaturated copolymer hydrogenation method and bimetallic catalyst system used by same NANDI CHEMICAL INDUSTRY CO LTD (CN) 1998-11-18 CN disclosed
EP-0041662-B1 RESIN ENCAPSULATION TYPE SEMICONDUCTOR DEVICE KABUSHIKI KAISHA TOSHIBA (JP) 1984-04-11 EP disclosed