SCHEMBL16068047

SCHEMBL16068047

c1ccc2cc(-c3c4ccccc4c(-c4ccc5[nH]c6c7ccccc7c7ccccc7c6c5c4)c4ccccc34)ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2B P41595 1/20 0.49
▸ HTR5A P47898 1/20 0.49
▸ PDE9A O76083 1/20 0.44
▸ GSK3B P49841 3/20 0.42
▸ GSK3A P49840 2/20 0.42
▸ CDK5 Q00535 2/20 0.42
▸ CDK5R1 Q15078 2/20 0.42
▸ KIF11 P52732 1/20 0.41
▸ CDK4 P11802 7/20 0.41
▸ CCND1 P24385 7/20 0.41
▸ GABRP O00591 1/20 0.41
▸ GABRD O14764 1/20 0.41
▸ GABRA1 P14867 1/20 0.41
▸ GABRB1 P18505 1/20 0.41
▸ GABRG2 P18507 1/20 0.41
▸ GABRB3 P28472 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ GABRA3 P34903 1/20 0.41
▸ GABRA2 P47869 1/20 0.41
▸ GABRB2 P47870 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
SCHEMBL16067884 0.97 HTR2B (0.47) HTR2BHTR5APDE9AGSK3BGSK3A
SCHEMBL16067798 0.95 HTR2B (0.45) HTR2BHTR5APDE9AGSK3BGSK3A
SCHEMBL16067799 0.95 HTR2B (0.45) HTR2BHTR5APDE9AGSK3BGSK3A
SCHEMBL16067874 0.95 HTR2B (0.45) HTR2BHTR5APDE9AGSK3BGSK3A
SCHEMBL16067808 0.94 HTR2B (0.44) HTR2BHTR5APDE9AGSK3BGSK3A
SCHEMBL16068094 0.92 KIF11 (0.46) HTR2BHTR5APDE9AGSK3BGSK3A
SCHEMBL16068048 0.91 KIF11 (0.45) HTR2BHTR5APDE9AGSK3BGSK3A
SCHEMBL16067675 0.91 CDK5 (0.48) HTR2BHTR5AGSK3BGSK3ACDK5
SCHEMBL16067778 0.89 HTR2B (0.46) HTR2BHTR5APDE9AGSK3BGSK3A
SCHEMBL16067879 0.88 GABRP (0.49) GSK3BGSK3ACDK5CDK5R1KIF11

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-2924029-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME Idemitsu Kosan Co., Ltd (JP) 2015-09-30 — — EP disclosed
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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