SCHEMBL13589746

SCHEMBL13589746

CCCCCCc1c(CCCCCC)c(-c2ccc(-c3ccc(C)s3)s2)c2nsnc2c1-c1ccc(-c2ccc(C)s2)s1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.36
▸ GCGR P47871 7/20 0.32
▸ GPR35 Q9HC97 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ TNF P01375 1/20 0.30
▸ HSF1 Q00613 1/20 0.30

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
SCHEMBL13589745 0.97 KCNH2 (0.38) KCNH2GCGRGPR35ALDH1A1MAPT
SCHEMBL13018477 0.88 — —
SCHEMBL13018476 0.88 — —
SCHEMBL13018486 0.88 — —
SCHEMBL23352500 0.80 MCHR1 (0.38) KCNH2
SCHEMBL15165574 0.79 CYP1A2 (0.32) TNFHSF1
SCHEMBL25451093 0.78 KDM4E (0.40) ALDH1A1MAPT
SCHEMBL12982491 0.77 KCNH2 (0.41) KCNH2GPR35ALDH1A1MAPTATM
SCHEMBL12982823 0.77 KCNH2 (0.41) KCNH2GPR35ALDH1A1MAPTATM
SCHEMBL14707005 0.77 — —

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
US-20090302748-A1 POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-12-10 — — US disclosed
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