SCHEMBL3359741

SCHEMBL3359741

COc1cncc(-c2cc3c(c(Nc4ccc(C5CCCNC5)cc4)n2)C(=O)[N]C=C3)c1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 3/20 0.49
SYK P43405 1/20 0.35

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
SCHEMBL3363298 0.86 ZAP70 (0.47) ZAP70SYK
SCHEMBL3359111 0.86 ZAP70 (0.52) ZAP70SYK
SCHEMBL3360188 0.85 ZAP70 (0.48) ZAP70SYK
SCHEMBL3358601 0.84 ZAP70 (0.49) ZAP70SYK
SCHEMBL3362351 0.84 ZAP70 (0.49) ZAP70SYK
SCHEMBL3359391 0.84 ZAP70 (0.44) ZAP70SYK
SCHEMBL3358518 0.83 ZAP70 (0.53) ZAP70SYK
SCHEMBL3362595 0.83 ZAP70 (0.48) ZAP70SYK
SCHEMBL3359055 0.83 ZAP70 (0.40) ZAP70SYK
SCHEMBL3362028 0.82 ZAP70 (0.49) ZAP70SYK

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 claimed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO claimed