SCHEMBL16067808

SCHEMBL16067808

c1cc(-c2ccc3[nH]c4c5ccccc5c5ccccc5c4c3c2)cc(-c2c3ccccc3c(-c3ccc(-c4ccc5ccccc5c4)cc3)c3ccccc23)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2B P41595 1/20 0.44
▸ HTR5A P47898 1/20 0.44
▸ CDK4 P11802 9/20 0.42
▸ CCND1 P24385 9/20 0.42
▸ PDE9A O76083 1/20 0.40
▸ FASN P49327 1/20 0.39
▸ GSK3B P49841 3/20 0.38
▸ GSK3A P49840 2/20 0.38
▸ CDK5 Q00535 2/20 0.38
▸ CDK5R1 Q15078 2/20 0.38
▸ HSD17B1 P14061 1/20 0.37
▸ HSD17B2 P37059 1/20 0.37
▸ KIF11 P52732 1/20 0.37
▸ GABRP O00591 1/20 0.36
▸ GABRD O14764 1/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ GABRB1 P18505 1/20 0.36
▸ GABRG2 P18507 1/20 0.36
▸ GABRB3 P28472 1/20 0.36
▸ GABRA5 P31644 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
SCHEMBL16067799 0.99 HTR2B (0.45) HTR2BHTR5ACDK4CCND1PDE9A
SCHEMBL16067874 0.99 HTR2B (0.45) HTR2BHTR5ACDK4CCND1PDE9A
SCHEMBL16067798 0.99 HTR2B (0.45) HTR2BHTR5ACDK4CCND1PDE9A
SCHEMBL16067884 0.96 HTR2B (0.47) HTR2BHTR5ACDK4CCND1PDE9A
SCHEMBL16068047 0.94 HTR2B (0.49) HTR2BHTR5ACDK4CCND1PDE9A
SCHEMBL16067804 0.91 CDK4 (0.44) HTR2BHTR5ACDK4CCND1GSK3B
SCHEMBL16067784 0.91 CDK4 (0.44) HTR2BHTR5ACDK4CCND1GSK3B
SCHEMBL16067497 0.90 CDK4 (0.41) HTR2BHTR5ACDK4CCND1PDE9A
SCHEMBL16068049 0.90 CDK4 (0.45) HTR2BHTR5ACDK4CCND1GSK3B
SCHEMBL16067809 0.90 CDK4 (0.45) HTR2BHTR5ACDK4CCND1GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014141725-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME 出光興産株式会社 (JP) 2014-09-18 — — WO disclosed
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