SCHEMBL3362296

SCHEMBL3362296

Cc1ncc(-c2cc3c(c(Nc4ccc(C5CCN(C)CC5)cc4)n2)C(=O)[N]C=C3)cn1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 1/20 0.49
MAP4K1 Q92918 16/20 0.41
BRD4 O60885 3/20 0.40
MAP4K3 Q8IVH8 1/20 0.39

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
SCHEMBL3360687 0.92 ZAP70 (0.47) ZAP70MAP4K1BRD4MAP4K3
SCHEMBL3362467 0.92 ZAP70 (0.49) ZAP70MAP4K1BRD4MAP4K3
SCHEMBL3363125 0.92 ZAP70 (0.49) ZAP70MAP4K1BRD4MAP4K3
SCHEMBL3357921 0.91 ZAP70 (0.47) ZAP70MAP4K1BRD4MAP4K3
SCHEMBL3363124 0.90 ZAP70 (0.46) ZAP70MAP4K1BRD4MAP4K3
SCHEMBL3359219 0.89 ZAP70 (0.41) ZAP70BRD4
SCHEMBL3362632 0.88 ZAP70 (0.45) ZAP70MAP4K1BRD4MAP4K3
SCHEMBL3362299 0.87 ZAP70 (0.44) ZAP70MAP4K1BRD4
SCHEMBL3358746 0.85 ZAP70 (0.43) ZAP70MAP4K1BRD4MAP4K3
SCHEMBL3361998 0.84 ZAP70 (0.42) ZAP70MAP4K1BRD4

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