SCHEMBL29638409

SCHEMBL29638409

COc1cccc(-n2[nH]c(=O)c3cnc(Nc4ccc(F)cn4)cc32)n1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BTK Q06187 15/20 0.46
SRC P12931 12/20 0.46
LYN P07948 9/20 0.43
ABL1 P00519 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 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
SCHEMBL24557274 1.00 BTK (0.46) BTKSRCLYNABL1JAK1
SCHEMBL29638394 0.83 TYK2 (0.40) BTKSRCLYNABL1JAK1
SCHEMBL27199231 0.83 TYK2 (0.40) BTKSRCLYNABL1JAK1
SCHEMBL29638480 0.82 BTK (0.45) BTKSRCLYNJAK1TYK2
SCHEMBL24557294 0.82 BTK (0.41) BTKSRCLYNJAK1TYK2
SCHEMBL24557272 0.82 BTK (0.45) BTKSRCLYNJAK1TYK2
SCHEMBL29638402 0.82 BTK (0.41) BTKSRCLYNJAK1TYK2
SCHEMBL24557265 0.81 JAK1 (0.43) BTKSRCLYNJAK1TYK2
SCHEMBL29638331 0.81 JAK1 (0.43) BTKSRCLYNJAK1TYK2
SCHEMBL24557309 0.81 JAK1 (0.46) BTKSRCLYNJAK1TYK2

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
WO-2022136914-A1 TYK2 INHIBITORS AND USES THEREOF SUDO BIOSCIENCES LIMITED (GB) 2022-06-30 WO disclosed