SCHEMBL18269166

SCHEMBL18269166

Cc1ncc(COc2cc(F)cc(Oc3ccc(-c4nn(C5CC6(CNC6)C5)c5ncnc(N)c45)cc3)c2)cn1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 17/20 0.52
▸ LCK P06239 2/20 0.46
▸ LYN P07948 1/20 0.46
▸ PIK3CD O00329 3/20 0.46
▸ NUDT14 O95848 1/20 0.46
▸ NUDT5 Q9UKK9 1/20 0.46
▸ SRC P12931 3/20 0.43
▸ KDR P35968 1/20 0.43
▸ TEK Q02763 1/20 0.43
▸ EGFR P00533 1/20 0.42

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
SCHEMBL18269007 0.89 SRC (0.57) BTKLCKLYNPIK3CDNUDT14
SCHEMBL18269008 0.89 BTK (0.52) BTKLCKLYNPIK3CDNUDT14
SCHEMBL15613529 0.88 BTK (0.61) BTKLCKLYNPIK3CDNUDT14
SCHEMBL18268991 0.88 BTK (0.55) BTKLCKLYNPIK3CDNUDT14
SCHEMBL18268660 0.86 BTK (0.53) BTKLCKLYNPIK3CDNUDT14
SCHEMBL15613558 0.86 BTK (0.52) BTKLCKLYNPIK3CDNUDT14
SCHEMBL18268976 0.86 BTK (0.68) BTKLCKLYNNUDT14NUDT5
SCHEMBL18269167 0.85 BTK (0.54) BTKPIK3CDSRCKDREGFR
SCHEMBL18269001 0.85 BTK (0.50) BTKLCKLYNPIK3CDNUDT14
SCHEMBL18269173 0.83 BTK (0.53) BTKLCKLYNPIK3CDNUDT14

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
WO-2016187723-A1 INHIBITORS OF THE TEC KINASE ENZYME FAMILY PHARMASCIENCE INC. (CA) 2016-12-01 — — WO disclosed
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