SCHEMBL29545283

SCHEMBL29545283

COc1c(Cl)cccc1Nc1c([Sn](C)(C)C)nn2c1C(=O)NCC2

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 15/20 0.38
PARP1 P09874 1/20 0.34
RAF1 P04049 1/20 0.32
PIM1 P11309 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
EGFR P00533 1/20 0.32

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
SCHEMBL29544373 0.86 TYK2 (0.41) TYK2PARP1
SCHEMBL29544491 0.83 BUB1 (0.38) TYK2PARP1RAF1EGFR
SCHEMBL29544530 0.79 TYK2 (0.37) TYK2EGFR
SCHEMBL29544730 0.78 EGFR (0.42) TYK2EGFR
SCHEMBL29544410 0.78 TYK2 (0.38) TYK2EGFR
SCHEMBL29544538 0.77 BRD4 (0.40) TYK2PARP1EGFR
SCHEMBL29544599 0.77 EGFR (0.36) TYK2RAF1EGFR
SCHEMBL29545037 0.77 TYK2 (0.34) TYK2PARP1PIM1PIM2EGFR
SCHEMBL29545774 0.77 TYK2 (0.35) TYK2EGFR
SCHEMBL29544640 0.74 EGFR (0.42) TYK2EGFR

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-2022072634-A1 BICYCLIC COMPOUNDS FOR USE IN THE TREATMENT CANCER SCORPION THERAPEUTICS, INC. (US) 2022-04-07 WO disclosed