SCHEMBL9073997

SCHEMBL9073997

c1ccc(C(CCCCC(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 6/20 0.71
HTR2A P28223 6/20 0.71
SIGMAR1 Q99720 4/20 0.64
TAAR1 Q96RJ0 1/20 0.52
CYP19A1 P11511 4/20 0.52
KCNH2 Q12809 2/20 0.48
CHRM2 P08172 1/20 0.48
HTR1A P08908 1/20 0.48
ADRA2A P08913 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
CHRM1 P11229 1/20 0.48
SMPD1 P17405 1/20 0.48
DRD1 P21728 1/20 0.48
TBXA2R P21731 1/20 0.48
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
ADRA1A P35348 1/20 0.48
OPRM1 P35372 1/20 0.48
DRD3 P35462 1/20 0.48
CASR P41180 1/20 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
SCHEMBL81907 0.87 SIGMAR1 (0.64) HRH1HTR2ASIGMAR1CYP19A1KCNH2
SCHEMBL7494993 0.87 HRH1 (0.64) HRH1HTR2ASIGMAR1TAAR1CYP19A1
SCHEMBL8120558 0.87 SIGMAR1 (0.59) HRH1HTR2ASIGMAR1TAAR1CYP19A1
SCHEMBL8416732 0.87 HRH1 (0.58) HRH1HTR2ASIGMAR1TAAR1CYP19A1
SCHEMBL2091869 0.87 HRH1 (0.58) HRH1HTR2ASIGMAR1TAAR1CYP19A1
SCHEMBL5070184 0.87 HRH1 (0.58) HRH1HTR2ASIGMAR1TAAR1CYP19A1
SCHEMBL5410942 0.87 HRH1 (0.58) HRH1HTR2ASIGMAR1CYP19A1
SCHEMBL6569660 0.87 SIGMAR1 (0.59) HRH1HTR2ASIGMAR1CYP19A1KCNH2
SCHEMBL4403161 0.87 HRH1 (0.86) HRH1HTR2ASIGMAR1TAAR1
SCHEMBL3290730 0.87 HRH1 (0.68) HRH1HTR2ASIGMAR1TAAR1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5487848-A Preparation of difunctional initiators for anionic polymerization XEROX CORPORATION (US) 1996-01-30 US claimed
EP-3303353-B1 PROCESS JOHNSON MATTHEY PLC (GB) 2022-01-12 EP disclosed
US-5487848-A Preparation of difunctional initiators for anionic polymerization XEROX CORPORATION (US) 1996-01-30 US disclosed
EP-0344165-B1 THERMOSET POLYMERS OF STYRENE TERMINATED TETRAKIS PHENOLS AlliedSignal Inc. (US) 1991-09-25 EP disclosed
EP-0344165-A1 THERMOSET POLYMERS OF STYRENE TERMINATED TETRAKIS PHENOLS. ALLIED CORP (US) 1989-12-06 EP disclosed
WO-1988005059-A1 THERMOSET POLYMERS OF STYRENE TERMINATED TETRAKIS PHENOLS ALLIED CORPORATION (US) 1988-07-14 WO disclosed
US-4728708-A Thermoset polymers of styrene terminated tetrakis phenols ALLIED CORPORATION (US) 1988-03-01 US disclosed