SCHEMBL9792188

SCHEMBL9792188

Cc1ccc(-c2nc3cccnc3n2Cc2nc(C)c[nH]2)cc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.46
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL9792209 0.91
SCHEMBL9792185 0.84 BRD4 (0.47) BRD4MEN1ALDH1A1KMT2A
SCHEMBL9792190 0.78 BRD4 (0.52) BRD4MEN1ALDH1A1KMT2A
SCHEMBL9792162 0.74
SCHEMBL2618364 0.74 ALDH1A1 (0.50) BRD4MEN1ALDH1A1KMT2A
SCHEMBL2618383 0.71 BRD4 (0.53) BRD4MEN1ALDH1A1KMT2A
SCHEMBL9792175 0.68 GRIN1 (0.47) BRD4MEN1ALDH1A1KMT2A
SCHEMBL16512494 0.68 BRD4 (0.64) BRD4MEN1ALDH1A1KMT2A
SCHEMBL9792170 0.68 ALDH1A1 (0.39) BRD4MEN1ALDH1A1KMT2A
SCHEMBL2602375 0.68 AKT1 (0.68) MEN1ALDH1A1KMT2A

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-5066654-A 2-aryl-3-heterocyclicmethyl-3H-imidazo[4,5-b]pyridines as anxiolytics and anticonvulsants A. H. ROBINS COMPANY, INCORPORATED (US) 1991-11-19 US claimed