SCHEMBL3832202

SCHEMBL3832202

Cc1ccnc(Nc2ncc(Sc3ccnc(C(=O)NCC(O)(c4ccccc4)c4ccccc4)c3)s2)c1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 17/20 0.50
▸ KDR P35968 1/20 0.44
▸ ITK Q08881 2/20 0.41
▸ LCK P06239 1/20 0.40

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
SCHEMBL2065104 0.91 NTRK1 (0.56) NTRK1KDRITK
SCHEMBL2065673 0.86 NTRK1 (0.54) NTRK1KDRITK
SCHEMBL2065418 0.84 KDR (0.41) NTRK1KDRLCK
SCHEMBL2065896 0.83 NTRK1 (0.50) NTRK1KDRITKLCK
SCHEMBL2065465 0.82 NTRK1 (0.55) NTRK1KDRITK
SCHEMBL2065419 0.81 NTRK1 (0.52) NTRK1KDRITKLCK
SCHEMBL2065522 0.81 NTRK1 (0.54) NTRK1KDRITK
SCHEMBL2067665 0.81 NTRK1 (0.54) NTRK1KDRITK
SCHEMBL2065902 0.80 NTRK1 (0.53) NTRK1KDRITKLCK
SCHEMBL2067692 0.80 SRC (0.56) KDRITKLCK

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-2099794-A2 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2009-09-16 — — EP disclosed
WO-2008079873-A2 THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-07-03 — — WO disclosed
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