SCHEMBL19490428

SCHEMBL19490428

Cc1ccc(COc2cc(F)cc(Oc3ccc(-c4nn(C5CCOCC5)c(N)c4C#N)cc3)c2)c[n+]1[O-]

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 19/20 0.38
▸ CMKLR1 Q99788 1/20 0.32

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
SCHEMBL15613496 0.92 BTK (0.40) BTK
SCHEMBL15613747 0.87 BTK (0.48) BTK
SCHEMBL16886132 0.84 BTK (0.49) BTK
SCHEMBL15613603 0.79 BTK (0.36) BTK
SCHEMBL15613607 0.79 BTK (0.36) BTK
SCHEMBL15613768 0.78 BTK (0.37) BTKCMKLR1
SCHEMBL15613606 0.78 BTK (0.37) BTK
SCHEMBL15613617 0.78 CSF1R (0.34) BTKCMKLR1
SCHEMBL15613605 0.78 BTK (0.36) BTK
SCHEMBL19484826 0.77 BTK (0.49) BTK

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9796716-B2 Selective inhibitors of Tec and Src protein kinase families PHARMASCIENCE, INC. (CA) 2017-10-24 — — US disclosed
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