SCHEMBL3361376

SCHEMBL3361376

Cc1cc(Nc2nc(-c3cncnc3)cc3c2C(=O)[N]C=C3)ccc1OC1CCN(C)CC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 3/20 0.42
ERBB2 P04626 12/20 0.37
EGFR P00533 4/20 0.36
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
P2RX3 P56373 1/20 0.34

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
SCHEMBL3357806 0.88 DYRK1A (0.40) ZAP70ERBB2EGFRHSP90AA1HSP90AB1
SCHEMBL3359250 0.86 ZAP70 (0.53) ZAP70
SCHEMBL3362708 0.81 ZAP70 (0.49) ZAP70
SCHEMBL3361858 0.81 ZAP70 (0.47) ZAP70
SCHEMBL3359095 0.79 ZAP70 (0.45) ZAP70EGFR
SCHEMBL1050272 0.78 ZAP70 (0.70) ZAP70ERBB2EGFR
SCHEMBL3360152 0.78 ZAP70 (0.64) ZAP70
SCHEMBL3359784 0.78 ZAP70 (0.51) ZAP70
SCHEMBL3362577 0.77 DYRK1A (0.48) ZAP70
SCHEMBL3359512 0.77 ZAP70 (0.51) ZAP70

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