SCHEMBL8101973

SCHEMBL8101973

CCCCCCCCCC(c1ccc(N)cc1)c1ccc(CCc2ccc(C(CCCCCCCCC)c3ccc(N)cc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.54
GFER P55789 1/20 0.47
MAOB P27338 4/20 0.46
MAOA P21397 2/20 0.46
S1PR2 O95136 2/20 0.43
S1PR1 P21453 2/20 0.43
CYP19A1 P11511 1/20 0.43
S1PR3 Q99500 1/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CSNK1E P49674 1/20 0.42

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
SCHEMBL8101757 1.00 HTR2A (0.54) HTR2AGFERMAOBMAOAS1PR2
SCHEMBL8085178 1.00 HTR2A (0.54) HTR2AGFERMAOBMAOAS1PR2
SCHEMBL8092067 1.00 HTR2A (0.54) HTR2AGFERMAOBMAOAS1PR2
SCHEMBL8093340 1.00 HTR2A (0.54) HTR2AGFERMAOBMAOAS1PR2
SCHEMBL8093251 1.00 HTR2A (0.54) HTR2AGFERMAOBMAOAS1PR2
SCHEMBL8086211 0.98 HTR2A (0.51) HTR2AGFERMAOBMAOAS1PR2
SCHEMBL8096145 0.95 HTR2A (0.60) HTR2AMAOBS1PR2S1PR1S1PR3
SCHEMBL8087470 0.95 HTR2A (0.60) HTR2AMAOBS1PR2S1PR1S1PR3
SCHEMBL8093327 0.95 HTR2A (0.60) HTR2AMAOBS1PR2S1PR1S1PR3
SCHEMBL8086368 0.95 HTR2A (0.60) HTR2AMAOBS1PR2S1PR1S1PR3

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-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
US-5807961-A Polyamic acid, polyimide film and liquid crystal aligning film and liquid crystal display element using the formers CHISSO CORPORATION (JP) 1998-09-15 US disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 US disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed