SCHEMBL8771701

SCHEMBL8771701

CCCCCc1ccccc1Cc1ccc(Cc2ccc(N)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.49
TLR8 Q9NR97 5/20 0.48
MAOB P27338 4/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LIPG Q9Y5X9 1/20 0.45
MAOA P21397 2/20 0.41
MAPT P10636 1/20 0.41
HTR6 P50406 1/20 0.41

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
SCHEMBL8771553 0.98 LIPG (0.47) HTR2ATLR8MAOBALDH1A1CYP3A4
SCHEMBL8771661 0.95 HTR2A (0.50) HTR2ATLR8MAOBALDH1A1CYP3A4
SCHEMBL8086301 0.89 LIPG (0.53) HTR2ATLR8ALDH1A1CYP3A4LIPG
SCHEMBL8679375 0.88 TLR8 (0.45) HTR2ATLR8MAOBALDH1A1CYP3A4
SCHEMBL8771537 0.88 HTR2A (0.53) HTR2AMAOBALDH1A1CYP3A4TSHR
SCHEMBL8093182 0.88 HTR2A (0.53) HTR2ATLR8LIPG
SCHEMBL8100866 0.88 LIPG (0.56) HTR2ATLR8ALDH1A1CYP3A4LIPG
SCHEMBL8098698 0.88 LIPG (0.56) HTR2ATLR8ALDH1A1CYP3A4LIPG
SCHEMBL8095272 0.88 LIPG (0.56) HTR2ATLR8ALDH1A1CYP3A4LIPG
SCHEMBL8094124 0.86 HTR2A (0.52) HTR2ATLR8ALDH1A1CYP3A4LIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0799270-A1 POLYAMIC ACID, POLYIMIDE FILM AND LIQUID CRYSTAL ALIGNING FILM AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1997-10-08 EP disclosed
WO-1997014742-A1 POLYAMIC ACID, POLYIMIDE FILM AND LIQUID CRYSTAL ALIGNING FILM AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1997-04-24 WO disclosed