SCHEMBL3434133

SCHEMBL3434133

Cc1cccc(-c2cc3cc[nH]c(=O)c3c(Nc3ccc(C4CCN(C(F)C(O)C(F)F)CC4)cc3)n2)n1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 18/20 0.53
FER P16591 1/20 0.36
LRRK2 Q5S007 1/20 0.36

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
SCHEMBL1044894 0.88 ZAP70 (0.58) ZAP70FER
SCHEMBL3394062 0.87 ZAP70 (0.60) ZAP70
SCHEMBL1049082 0.85 ZAP70 (0.71) ZAP70FER
SCHEMBL1047910 0.84 ZAP70 (0.64) ZAP70
SCHEMBL1045966 0.84 ZAP70 (0.52) ZAP70
SCHEMBL1047320 0.83 ZAP70 (0.53) ZAP70
SCHEMBL1045390 0.83 ZAP70 (0.58) ZAP70FER
SCHEMBL1048279 0.83 ZAP70 (0.57) ZAP70FER
SCHEMBL1045571 0.82 ZAP70 (0.55) ZAP70FERLRRK2
SCHEMBL1048263 0.82 ZAP70 (0.56) ZAP70FER

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
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO disclosed