SCHEMBL20589115

SCHEMBL20589115

Cc1ncc(-c2ccc3c(C(N)=O)nn(CC(=O)O)c3c2)cn1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 1/20 0.40
▸ WDR77 Q9BQA1 1/20 0.40
▸ GRIN2B Q13224 1/20 0.39
▸ CFD P00746 15/20 0.39
▸ HSD17B10 Q99714 1/20 0.38
▸ RAB9A P51151 1/20 0.37
▸ LMNA P02545 1/20 0.37

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
SCHEMBL20589642 0.92 CFD (0.45) CFD
SCHEMBL20589530 0.89 HSD17B10 (0.39) GRIN2BCFDHSD17B10
SCHEMBL29544970 0.89 CFD (0.46) CFD
SCHEMBL18555224 0.89 CFD (0.46) CFD
SCHEMBL18555959 0.85 CFD (0.45) CFD
Trifluoroacetic Acid SCHEMBL20588836 0.84 CFD (0.46) CFD
SCHEMBL15541535 0.82 CFD (0.48) CFDHSD17B10RAB9ALMNA
SCHEMBL18549721 0.81 CFD (0.54) CFD
SCHEMBL29468402 0.81 CFD (0.54) CFD
SCHEMBL16738258 0.80 CFD (0.46) CFDHSD17B10

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-2018229543-A2 THERAPEUTIC INHIBITORY COMPOUNDS LIFESCI PHARMACEUTICALS, INC. (BB) 2018-12-20 — — WO disclosed
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