SCHEMBL3832197

SCHEMBL3832197

Cc1ccnc(Nc2ncc(Sc3ccnc(C(N)=O)c3CC(O)(c3ccccc3)c3ccccc3)s2)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 12/20 0.45
▸ KDR P35968 1/20 0.43
▸ JAK2 O60674 1/20 0.41
▸ JAK3 P52333 4/20 0.39
▸ BTK Q06187 3/20 0.39
▸ TXK P42681 1/20 0.38
▸ LCK P06239 1/20 0.38
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ CASP3 P42574 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SENP8 Q96LD8 1/20 0.36
▸ SENP7 Q9BQF6 1/20 0.36
▸ SENP6 Q9GZR1 1/20 0.36

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
SCHEMBL3825428 0.90 NTRK1 (0.49) NTRK1KDRJAK3BTKTXK
SCHEMBL2065418 0.81 KDR (0.41) NTRK1KDRJAK3BTKTXK
SCHEMBL3844605 0.80 SRC (0.54) KDRJAK2JAK3BTKTXK
SCHEMBL3832186 0.76 NTRK1 (0.47) NTRK1KDRJAK3BTKTXK
SCHEMBL3832202 0.75 NTRK1 (0.50) NTRK1KDRLCK
SCHEMBL2065481 0.75 KDR (0.47) NTRK1KDRJAK3BTKTXK
SCHEMBL2068462 0.75 NTRK1 (0.41) NTRK1KDRJAK3BTKTXK
SCHEMBL2065432 0.74 KDR (0.39) NTRK1KDRJAK3BTKTXK
SCHEMBL3827871 0.74 NTRK1 (0.38) NTRK1KDRJAK3BTK
SCHEMBL2065977 0.74 KDR (0.40) NTRK1KDRJAK3BTKTXK

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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