SCHEMBL24192635

SCHEMBL24192635

CBn1nc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NUDT14 O95848 2/20 0.72
▸ NUDT5 Q9UKK9 2/20 0.72
▸ BTK Q06187 16/20 0.61
▸ LCK P06239 8/20 0.61
▸ LYN P07948 4/20 0.61
▸ SRC P12931 6/20 0.56
▸ KDR P35968 3/20 0.56
▸ TEK Q02763 3/20 0.56
▸ PIK3CD O00329 1/20 0.55
▸ PIK3CA P42336 1/20 0.55
▸ PIK3CB P42338 1/20 0.55
▸ PIK3CG P48736 1/20 0.55
▸ PRKDC P78527 1/20 0.55
▸ FYN P06241 4/20 0.52
▸ ITK Q08881 3/20 0.52
▸ BMX P51813 3/20 0.52
▸ EGFR P00533 2/20 0.52
▸ JAK3 P52333 2/20 0.52
▸ HCK P08631 3/20 0.52
▸ FGR P09769 3/20 0.52

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
SCHEMBL25937452 0.88 NUDT14 (0.69) NUDT14NUDT5BTKLCKLYN
SCHEMBL24196500 0.88 NUDT14 (0.69) NUDT14NUDT5BTKLCKLYN
SCHEMBL24196427 0.87 NUDT14 (0.68) NUDT14NUDT5BTKLCKLYN
SCHEMBL25466526 0.87 NUDT14 (0.68) NUDT14NUDT5BTKLCKLYN
SCHEMBL130529 0.84 NUDT14 (1.00) NUDT14NUDT5BTKLCKLYN
SCHEMBL18176199 0.83 NUDT14 (0.75) NUDT14NUDT5BTKLCKLYN
SCHEMBL3617461 0.81 SRC (0.79) NUDT14NUDT5BTKLCKLYN
SCHEMBL25069027 0.81 SRC (0.76) NUDT14NUDT5LCKSRCKDR
SCHEMBL25069189 0.81 NUDT14 (0.72) NUDT14NUDT5BTKLCKLYN
SCHEMBL25479854 0.78 BTK (0.69) NUDT14NUDT5BTKLCKLYN

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-2022007824-A1 COMPOUND HAVING BTK KINASE DEGRADING ACTIVITY, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREFOR 四川海思科制药有限公司 2022-01-13 — — WO disclosed
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