SCHEMBL24426166

SCHEMBL24426166

CN(Cc1ccc(-c2ccnc3[nH]c(=O)[nH]c23)cc1C(C)(F)F)C(O)c1nc(C2(C)CC2)no1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 19/20 0.45
▸ BRD4 O60885 1/20 0.33
▸ LCK P06239 2/20 0.31

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
SCHEMBL19891974 0.78 BTK (0.44) BTKBRD4LCK
SCHEMBL24426204 0.77 BTK (0.45) BTKBRD4LCK
SCHEMBL19876220 0.76 BTK (0.57) BTKLCK
SCHEMBL24426199 0.76 BTK (0.42) BTKBRD4LCK
SCHEMBL19876222 0.71 BTK (0.43) BTKBRD4
SCHEMBL24426168 0.68 BTK (0.51) BTKLCK
SCHEMBL19876179 0.66 BTK (0.82) BTKLCK
SCHEMBL19876207 0.66 BTK (0.60) BTKLCK
SCHEMBL19876216 0.65 BTK (0.57) BTKBRD4
Hydrochloric Acid SCHEMBL19876241 0.65 BTK (0.56) BTKBRD4

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
EP-3500569-B1 2-OXO-IMIDAZOPYRIDINES AS REVERSIBLE BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2022-05-18 — — EP disclosed
Send feedback