SCHEMBL28055955

SCHEMBL28055955

CCOc1cc2c(-c3cccc(N)c3)ccc(C(N)=O)c2[nH]1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTK Q06187 17/20 0.45
PARP1 P09874 1/20 0.40
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 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
SCHEMBL16336069 0.85 BTK (0.46) BTKPARP1
SCHEMBL21008529 0.84 BTK (0.40) BTK
SCHEMBL16336539 0.84 BTK (0.41) BTKPARP1
SCHEMBL16336682 0.83 BTK (0.54) BTKPARP1
SCHEMBL28055902 0.80 BTK (0.66) BTK
SCHEMBL16336244 0.79 BTK (0.42) BTKPARP1
SCHEMBL16338011 0.78 BTK (0.47) BTKPARP1
SCHEMBL28321282 0.77 TP53 (0.36)
SCHEMBL16337932 0.75 BTK (0.70) BTK
SCHEMBL16337236 0.73 BTK (0.50) BTKPARP1MKNK2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105530932-B Primary formamide as BTK inhibitor 艾伯维公司 2019-09-27 CN disclosed
CN-105530932-A Primary carboxamides as BIK inhibitors ABBVIE INC 2016-04-27 CN disclosed