SCHEMBL24061702

SCHEMBL24061702

CC(C)(C)C1NC(C(=O)NCc2ccc(-c3ccnc4[nH]c(-c5ccc(N6CCC(F)CC6)cn5)nc34)cc2F)=NO1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.41
▸ LCK P06239 2/20 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
SCHEMBL24061669 0.95 BTK (0.42) BTKLCK
SCHEMBL24061660 0.87 BTK (0.41) BTKLCK
SCHEMBL17645959 0.84 BTK (0.47) BTK
SCHEMBL17646054 0.84 BTK (0.59) BTKLCK
SCHEMBL24061539 0.83 BTK (0.57) BTKLCK
SCHEMBL24061675 0.80 BTK (0.52) BTKLCK
SCHEMBL17645787 0.80 BTK (0.58) BTKLCK
SCHEMBL17660389 0.79 BTK (0.43) BTK
SCHEMBL24061623 0.78 BTK (0.41) BTKLCK
SCHEMBL17645843 0.78 BTK (0.61) BTKLCK

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-3204382-B1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2021-12-01 — — EP disclosed
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