SCHEMBL24061704

SCHEMBL24061704

CC(C)(C)C(=N)NC(=O)C(=O)NCc1ccc(-c2ccnc3[nH]c(C4CC4)nc23)cc1F

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.51

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
SCHEMBL17645973 0.82 BTK (0.65) BTK
SCHEMBL17645837 0.79 BTK (0.79) BTK
SCHEMBL17645743 0.79 BTK (0.70) BTK
SCHEMBL17645960 0.79 BTK (0.80) BTK
SCHEMBL17645829 0.79 BTK (0.80) BTK
SCHEMBL17645851 0.76 BTK (0.46) BTK
SCHEMBL17645667 0.72 BTK (0.81) BTK
SCHEMBL17645735 0.71 BTK (0.81) BTK
SCHEMBL17645983 0.71 BTK (0.81) BTK
SCHEMBL20878560 0.70 BTK (0.66) 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 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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