SCHEMBL29533086

SCHEMBL29533086

Cc1cc(-c2ccnc(NC(=O)[C@@H]3C[C@@H]3F)c2)ccc1CNC(=O)c1noc(C(C)(C)C)n1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 11/20 0.51
▸ LCK P06239 1/20 0.44
▸ ABL1 P00519 9/20 0.41

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
SCHEMBL29533357 1.00 BTK (0.51) BTKLCKABL1
SCHEMBL29533301 1.00 BTK (0.51) BTKLCKABL1
SCHEMBL29532920 1.00 BTK (0.51) BTKLCKABL1
SCHEMBL22659984 1.00 BTK (0.51) BTKLCKABL1
SCHEMBL22659377 1.00 BTK (0.51) BTKLCKABL1
SCHEMBL29533338 1.00 BTK (0.51) BTKLCKABL1
SCHEMBL22659428 1.00 BTK (0.51) BTKLCKABL1
SCHEMBL22659932 1.00 BTK (0.51) BTKLCKABL1
SCHEMBL22659731 1.00 BTK (0.51) BTKLCKABL1
SCHEMBL22659361 0.93 BTK (0.51) BTKLCKABL1

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-3969124-A1 INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE Biogen MA Inc. (US) 2022-03-23 — — EP disclosed
Send feedback