SCHEMBL13759438

SCHEMBL13759438

O=C(O)CNc1ccc2[nH]c(-c3ccc(Cl)s3)nc2c1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 17/20 0.43
▸ DGAT1 O75907 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL3861744 0.80 F10 (0.47) F10
SCHEMBL8346713 0.80 F10 (0.47) F10HDAC6
SCHEMBL3865007 0.79 F10 (0.40) F10HDAC6
SCHEMBL3863014 0.78 CSNK2A2 (0.49) F10HDAC6
SCHEMBL3873919 0.76 PDE2A (0.45) F10
SCHEMBL4687144 0.75 F10 (0.40) F10HDAC6
SCHEMBL3868472 0.75 F10 (0.73) F10
SCHEMBL3868441 0.75 F10 (0.40) F10HDAC6
SCHEMBL8346292 0.74 F10 (0.43) F10
SCHEMBL8344703 0.72 ALDH1A1 (0.46) F10

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
US-7566789-B2 Benzimidazole derivatives MERCK PATENT GMBH (DE) 2009-07-28 — — US disclosed
US-7566789-B2 Benzimidazole derivatives MERCK PATENT GMBH (DE) 2009-07-28 — — US disclosed
Send feedback