SCHEMBL19892015

SCHEMBL19892015

O=CNCc1ccc(-c2ccnc3[nH]c(=O)[nH]c23)cc1F

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 18/20 0.58
▸ BRD4 O60885 1/20 0.46
▸ ENPP1 P22413 1/20 0.39

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
SCHEMBL19876272 0.84 BTK (0.56) BTKBRD4ENPP1
SCHEMBL19876288 0.77 BTK (0.67) BTK
SCHEMBL19876262 0.75 BTK (1.00) BTK
SCHEMBL24426165 0.75 BTK (0.80) BTK
SCHEMBL19876257 0.75 BTK (0.69) BTK
SCHEMBL19876226 0.74 BTK (1.00) BTK
SCHEMBL19876264 0.73 BTK (1.00) BTK
SCHEMBL28661321 0.73 BTK (0.57) BTKBRD4
SCHEMBL19876243 0.73 BTK (1.00) BTK
SCHEMBL19876267 0.73 BTK (0.73) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3500569-B1 2-OXO-IMIDAZOPYRIDINES AS REVERSIBLE BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2022-05-18 — — EP disclosed
WO-2018035080-A1 2-OXO-IMIDAZOPYRIDINES AS REVERSIBLE BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2018-02-22 — — WO disclosed
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