SCHEMBL3409340

SCHEMBL3409340

Bc1ccc2nnc(C(C)c3ccc(Cl)nn3)n2c1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.34
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 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
SCHEMBL250864 0.84 MAPK14 (0.34) MAPK14LMNAKMT2AALDH1A1GAA
SCHEMBL253756 0.68 MEN1 (0.36) MAPK14KMT2AALDH1A1GAA
SCHEMBL3407742 0.66 KDR (0.43)
SCHEMBL11914746 0.63 MAPK14 (0.58) MAPK14
SCHEMBL2600116 0.62 ALDH1A1 (0.46) LMNAKMT2AALDH1A1GAA
SCHEMBL24634836 0.60 ALDH1A1 (0.43) LMNAKMT2AALDH1A1GAA
SCHEMBL20233507 0.60 ALDH1A1 (0.43) LMNAKMT2AALDH1A1GAA
SCHEMBL4199616 0.59 MAPK14 (0.46) MAPK14
SCHEMBL17229785 0.58 MAPK14 (0.48) MAPK14
SCHEMBL27108463 0.58 MAPK14 (0.47) MAPK14

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-2012003338-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-05 WO disclosed