SCHEMBL2603884

SCHEMBL2603884

Nc1cc(Cl)cc(Oc2ccnc(N)c2N=O)c1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SCN9A Q15858 2/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ SCN5A Q14524 1/20 0.32
▸ PLAU P00749 1/20 0.31

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
SCHEMBL13610891 0.80 MEN1 (0.43) MAPTKMT2ACYP3A4
SCHEMBL9910290 0.77 CDK1 (0.39) MAPTKMT2ACYP3A4PLAU
SCHEMBL1791223 0.76 EPAS1 (0.43) MAPTKMT2A
SCHEMBL2604029 0.71 LMNA (0.34) KMT2ACYP3A4
SCHEMBL15925253 0.70 L3MBTL1 (0.46) KMT2ATP53
SCHEMBL7190886 0.68 CYP3A4 (0.60) MAPTKMT2ASCN9ATP53CYP3A4
SCHEMBL12503575 0.67 MGMT (0.35) MAPTKMT2APLAU
SCHEMBL7184434 0.65 PDE7A (0.45) MAPTKMT2ATP53CYP3A4
SCHEMBL13610940 0.65 BRAF (0.59) MAPTKMT2A
SCHEMBL2603522 0.64 FYN (0.43) KMT2ACYP3A4

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
EP-2013207-B1 IMIDAZO[4,5-B]PYRIDIN-2-ONE COMPOUNDS AND ANALOGS THEREOF AS CANCER THERAPEUTIC COMPOUNDS CANCER REC TECH LTD (GB) 2012-04-25 — — EP disclosed
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