SCHEMBL19490391

SCHEMBL19490391

Nc1ncnc2c1c(-c1ccc(Oc3cc(OCc4cncs4)ccc3CN3CCN(CCn4nc(-c5ccc(Oc6cccc(OCc7cncs7)c6)cc5)c5c(N)ncnc54)CC3)cc1)nn2CCc1ccncc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 13/20 0.42
▸ SRC P12931 8/20 0.40
▸ FGR P09769 5/20 0.40
▸ YES1 P07947 4/20 0.40
▸ PIK3CD O00329 1/20 0.40
▸ PIK3CA P42336 1/20 0.40
▸ PIK3CB P42338 1/20 0.40
▸ PIK3CG P48736 1/20 0.40
▸ PRKDC P78527 1/20 0.40
▸ FGFR1 P11362 2/20 0.39
▸ FGFR2 P21802 2/20 0.39
▸ FYN P06241 7/20 0.39
▸ LYN P07948 6/20 0.39
▸ PTK6 Q13882 5/20 0.39
▸ HCK P08631 4/20 0.39
▸ BLK P51451 3/20 0.39
▸ FRK P42685 2/20 0.39
▸ MAP2K5 Q13163 3/20 0.38
▸ FLT3 P36888 4/20 0.37
▸ LCK P06239 3/20 0.37

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
SCHEMBL15613547 0.89 BTK (0.50) BTKSRCFGRYES1PIK3CD
SCHEMBL15613553 0.85 SRC (0.56) BTKSRCFGRYES1FGFR1
SCHEMBL15613540 0.85 BTK (0.48) BTKSRCFGRYES1FGFR1
SCHEMBL15613692 0.84 BTK (0.47) BTKSRCFGRYES1FGFR1
SCHEMBL15613548 0.84 BTK (0.57) BTKSRCFGRYES1PIK3CD
SCHEMBL15613698 0.81 FGFR2 (0.46) BTKSRCFGRYES1FGFR1
SCHEMBL15613518 0.77 BTK (0.53) BTKSRCFGRYES1PIK3CD
SCHEMBL15613510 0.76 NUDT14 (0.63) BTKSRCPIK3CDPIK3CAPIK3CB
SCHEMBL16886172 0.73 FGFR2 (0.47) BTKSRCFGRYES1FGFR1
SCHEMBL15613668 0.72 BTK (0.66) BTKSRCFGRYES1PIK3CD

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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