SCHEMBL6907393

SCHEMBL6907393

CCCCN(CCc1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.52
DRD3 P35462 2/20 0.52
KCNH2 Q12809 2/20 0.52
CHRM2 P08172 1/20 0.52
HTR1A P08908 1/20 0.52
ADRA2A P08913 1/20 0.52
CHRM1 P11229 1/20 0.52
DRD1 P21728 1/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A4 P31645 1/20 0.52
ADRA1A P35348 1/20 0.52
SLC6A3 Q01959 1/20 0.52
DRD2 P14416 1/20 0.50
OPRD1 P41143 1/20 0.50
OPRK1 P41145 1/20 0.50
CNR2 P34972 1/20 0.49
TSHR P16473 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
NR1H2 P55055 2/20 0.48
NR1H3 Q13133 2/20 0.48

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
SCHEMBL10526946 0.94 KCNH2 (0.58) OPRM1DRD3KCNH2CHRM2HTR1A
SCHEMBL3390445 0.89 KCNH2 (0.63) OPRM1DRD3KCNH2CHRM2HTR1A
SCHEMBL6907944 0.89 TAAR1 (0.52) OPRM1DRD3KCNH2CHRM2HTR1A
SCHEMBL6883672 0.89 DRD2 (0.55) OPRM1DRD3CHRM2ADRA2ACHRM1
SCHEMBL107013 0.88 CNR2 (0.49) CNR2TSHRNR1H2NR1H3
SCHEMBL30505454 0.87 KCNH2 (0.55) OPRM1DRD3KCNH2CHRM2HTR1A
SCHEMBL18074044 0.86 CNR2 (0.48) CNR2TSHRNR1H2NR1H3
Hydrochloric Acid SCHEMBL2141325 0.86 CNR2 (0.48) CNR2TSHRNR1H2NR1H3
SCHEMBL3006764 0.86 TAAR1 (0.56) OPRM1DRD3KCNH2CHRM2HTR1A
SCHEMBL11326511 0.86 OPRM1 (0.49) OPRM1DRD3KCNH2CHRM2HTR1A

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
US-6822057-B2 OLEFIN POLYMERIZATION CATALYST SYSTEM IS A REACTION PRODUCT OF A METALLOCENES AND A COCATALYST CONTAINING FLUOROARYL SUBSTITUTED SECONDARY AMINE OR PHSOPHINE COMPOUND AND AN ANION CONTAINING GROUP 13 ELEMENT WHICH IS NONCOORDINATIG EXXON MOBIL CHEMICAL PATENTS INC. 2004-11-23 US disclosed
US-6489480-B2 COORDINATION POLYMERIZATION CATALYST FOR ALPHA-OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2002-12-03 US disclosed
US-20020115806-A1 Olefin polymerization catalysts derived from Group-15 cationic compounds and processes using them EXXONMOBIL CHEMICAL PATENTS INC. 2002-08-22 US disclosed
US-20020111265-A1 GROUP-15 CATIONIC COMPOUNDS FOR OLEFIN POLYMERIZATION CATALYSTS EXXONMOBIL CHEMICAL PATENTS INC. 2002-08-15 US disclosed
US-4243584-A Monoazo dyestuffs containing diazo component substituted by disulfimide and trifluoromethyl groups BAYER AKTIENGESELLSCHAFT (DE) 1981-01-06 US disclosed
US-4159265-A Phenylazopyrazolo dyestuffs including disulfimide substituent BAYER AKTIENGESELLSCHAFT (DE) 1979-06-26 US disclosed
US-4059402-A SUBLIMATION, MONOAZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-11-22 US disclosed
US-3978039-A POLYAMIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-24 US disclosed