SCHEMBL6939847

SCHEMBL6939847

COCCOCCC1c2ccccc2-c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.42
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
AR P10275 1/20 0.35
GPR3 P46089 1/20 0.34
ADRB2 P07550 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP3A4 P08684 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TDO2 P48775 1/20 0.33
GAA P10253 1/20 0.33
ADRB1 P08588 1/20 0.33
ALOX5 P09917 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL8715984 1.00 HTR2A (0.42) HTR2APPARGPPARACA1CA2
SCHEMBL6545345 0.90 HTR2A (0.40) HTR2APPARGPPARACA1CA2
SCHEMBL16431106 0.82 HTR2A (0.42) HTR2APPARGPPARACA1CA2
Hydrochloric Acid SCHEMBL4633578 0.73 HTR2A (0.38) HTR2APPARGPPARACA1CA2
SCHEMBL5353138 0.73 HTR2A (0.64) HTR2ACA1CA2GPR3MEN1
SCHEMBL456018 0.72 CA1 (0.53) HTR2ACA1CA2GPR3KMT2A
SCHEMBL31501939 0.72 CA1 (0.53) HTR2ACA1CA2GPR3KMT2A
SCHEMBL10768875 0.72 HDAC3 (0.37) ARADRB2MEN1KMT2ASMN1; SMN2
SCHEMBL30696221 0.72 KDM4E (0.44) HTR2APPARGPPARAADRB2MEN1
SCHEMBL7574105 0.71 HTR2A (0.61) HTR2ACA1CA2GPR3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885461-B1 POLYFLUORENES AS MATERIALS FOR PHOTOLUMINESCENCE AND ELECTROLUMINESCENCE DUPONT DISPLAYS INC (US) 2003-08-13 EP disclosed
US-5900327-A LIGHT EMITTING SOLID STATE DEVICE UNIAX CORPORATION (US) 1999-05-04 US disclosed
EP-0885461-A1 POLYFLUORENES AS MATERIALS FOR PHOTOLUMINESCENCE AND ELECTROLUMINESCENCE UNIAX CORPORATION (US) 1998-12-23 EP disclosed
WO-1997033323-A1 POLYFLUORENES AS MATERIALS FOR PHOTOLUMINESCENCE AND ELECTROLUMINESCENCE UNIAX CORPORATION (US) 1997-09-12 WO disclosed