SCHEMBL9700663

SCHEMBL9700663

CN(C)c1ccc(-c2ccc(-c3nnn[nH]3)c(=O)[nH]2)cc1Br

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
NOTUM Q6P988 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
SCHEMBL9700393 0.78
SCHEMBL9700756 0.77 SNCA (0.37) MAPT
SCHEMBL9525656 0.76 NOTUM (0.40) MAPTNOTUM
SCHEMBL9251638 0.75 PTGER3 (0.46)
SCHEMBL9528858 0.73 TNKS (0.44)
SCHEMBL9525928 0.73 CYP11B1 (0.33) MAPT
SCHEMBL9700635 0.72 GAA (0.39) MAPT
SCHEMBL9701671 0.72 BRD4 (0.42) NOTUM
SCHEMBL9700666 0.72 ALDH1A1 (0.53) NOTUM
SCHEMBL9700701 0.72 NOTUM (0.41) MAPTNOTUM

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
WO-1992006085-A1 PHENYLPYRIDINOL DERIVATIVES AS MEDICAMENTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1992-04-16 WO claimed
WO-1992006085-A1 PHENYLPYRIDINOL DERIVATIVES AS MEDICAMENTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1992-04-16 WO disclosed