SCHEMBL1159549

SCHEMBL1159549

Cc1ncc(-c2cc3c(c(Nc4ccc(C5CCN(CCCF)CC5)c(C)c4)n2)C(=O)[N]C=C3)cn1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 4/20 0.40
SYK P43405 11/20 0.36
WEE1 P30291 1/20 0.33
JAK2 O60674 2/20 0.31
CCR2 P41597 2/20 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
SCHEMBL3359648 0.85 ZAP70 (0.48) ZAP70SYKWEE1
SCHEMBL3358316 0.84 ZAP70 (0.39) ZAP70SYKCCR2
SCHEMBL3361273 0.82 SYK (0.43) ZAP70SYKWEE1JAK2
SCHEMBL3360670 0.82 ZAP70 (0.48) ZAP70SYKWEE1JAK2
SCHEMBL3359250 0.81 ZAP70 (0.53) ZAP70SYKWEE1JAK2
SCHEMBL1158070 0.80 ZAP70 (0.64) ZAP70SYK
SCHEMBL3359219 0.80 ZAP70 (0.41) ZAP70SYK
SCHEMBL3357832 0.80 ZAP70 (0.42) ZAP70SYKWEE1
SCHEMBL3360946 0.79 ZAP70 (0.51) ZAP70SYKWEE1
SCHEMBL1158376 0.79 SYK (0.36) 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-2459556-A1 2, 7 -NAPHTHYRIDIN- 1 -ONE DERIVATIVES AS SYK KINASE INHIBITORS IRM LLC (BM) 2012-06-06 EP claimed
WO-2011014515-A1 2, 7 -NAPHTHYRIDIN- 1 -ONE DERIVATIVES AS SYK KINASE INHIBITORS IRM LLC (BM) 2011-02-03 WO claimed