SCHEMBL30044972

SCHEMBL30044972

Cc1cc(-c2ncncc2OCCBr)ccc1CNC(=O)c1noc(C(C)(C)C)n1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.51
▸ LCK P06239 1/20 0.40

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
SCHEMBL23605813 1.00 BTK (0.51) BTKLCK
SCHEMBL23579182 0.91 BTK (0.51) BTKLCK
SCHEMBL30044561 0.86 BTK (0.58) BTK
SCHEMBL23605794 0.86 BTK (0.58) BTK
SCHEMBL30044254 0.86 BTK (0.56) BTKLCK
SCHEMBL23605462 0.86 BTK (0.56) BTKLCK
Hydrochloric Acid SCHEMBL29418592 0.79 BTK (0.51) BTKLCK
Hydrochloric Acid SCHEMBL25212574 0.79 BTK (0.51) BTKLCK
SCHEMBL25212569 0.79 BTK (0.49) BTKLCK
SCHEMBL29418541 0.79 BTK (0.49) 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-4081514-A1 BTK INHIBITORS Biogen MA Inc. (US) 2022-11-02 — — EP disclosed
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