SCHEMBL19490431

SCHEMBL19490431

BC(B)(Oc1cc(F)cc(Oc2ccc(-c3nn(C4CCOCC4)c4ncnc(N)c34)cc2)c1)c1cncn1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 12/20 0.49
▸ NUDT14 O95848 1/20 0.49
▸ NUDT5 Q9UKK9 1/20 0.49
▸ LCK P06239 6/20 0.48
▸ LYN P07948 1/20 0.48
▸ SRC P12931 7/20 0.47
▸ KDR P35968 4/20 0.47
▸ TEK Q02763 1/20 0.47
▸ EGFR P00533 6/20 0.45
▸ PIK3CD O00329 5/20 0.45
▸ ABL1 P00519 3/20 0.45
▸ HCK P08631 3/20 0.45
▸ PIK3CA P42336 3/20 0.45
▸ PIK3CB P42338 3/20 0.45
▸ MTOR P42345 3/20 0.45
▸ PIK3CG P48736 3/20 0.45
▸ EPHB4 P54760 3/20 0.45
▸ PRKDC P78527 3/20 0.45
▸ PI4KB Q9UBF8 2/20 0.45
▸ CSK P41240 2/20 0.44

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
SCHEMBL19490432 0.91 BTK (0.47) BTK
SCHEMBL19490444 0.85 BTK (0.49) BTKNUDT14NUDT5LCKLYN
SCHEMBL19490558 0.85 BTK (0.49) BTKNUDT14NUDT5LCKLYN
SCHEMBL15613549 0.85 BTK (0.51) BTKNUDT14NUDT5LCKLYN
SCHEMBL16886130 0.84 BTK (0.50) BTKNUDT14NUDT5LCKLYN
SCHEMBL15613514 0.84 BTK (0.50) BTKNUDT14NUDT5LCKLYN
SCHEMBL15613673 0.80 BTK (0.55) BTKNUDT14NUDT5LCKLYN
SCHEMBL15613544 0.80 BTK (0.49) BTKNUDT14NUDT5LCKLYN
SCHEMBL15613652 0.80 BTK (0.54) BTKNUDT14NUDT5LCKLYN
SCHEMBL15613753 0.79 BTK (0.48) BTKNUDT14NUDT5LCKLYN

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
Send feedback