SCHEMBL8771576

SCHEMBL8771576

CCCCCC(c1ccc(N)cc1)c1ccc(CC)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.44
CYP19A1 P11511 2/20 0.43
MAPT P10636 2/20 0.42
CSNK1E P49674 1/20 0.40
TSHR P16473 2/20 0.39
MAPK1 P28482 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SLC2A1 P11166 1/20 0.36
MAOB P27338 2/20 0.36
HRH1 P35367 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL8771618 0.98 HTR2A (0.46) HTR2ACYP19A1MAPTCSNK1ETSHR
SCHEMBL8771422 0.98 HTR2A (0.46) HTR2ACYP19A1MAPTCSNK1ETSHR
SCHEMBL8771510 0.98 HTR2A (0.46) HTR2ACYP19A1MAPTCSNK1ETSHR
SCHEMBL8771496 0.98 HTR2A (0.46) HTR2ACYP19A1MAPTCSNK1ETSHR
SCHEMBL8771524 0.98 HTR2A (0.46) HTR2ACYP19A1MAPTCSNK1ETSHR
SCHEMBL8771501 0.95 CYP19A1 (0.43) HTR2ACYP19A1MAPTTSHRMAPK1
SCHEMBL8096580 0.91 CYP19A1 (0.46) HTR2ACYP19A1MAPTCSNK1ETSHR
SCHEMBL13523887 0.91 CYP19A1 (0.46) HTR2ACYP19A1MAPTCSNK1ETSHR
SCHEMBL8086211 0.90 HTR2A (0.51) HTR2ACYP19A1MAPTCSNK1ESIGMAR1
SCHEMBL8098205 0.90 CYP3A4 (0.48) HTR2ACYP19A1MAPTCSNK1ETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1173886-A Polyamic acid, polyimide film and liquid crystal aligning film and liquid crystal display element CHISSO CORP (JP) 1998-02-18 CN disclosed
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