SCHEMBL31723375

SCHEMBL31723375

O=c1[nH]ccc2ccc(Br)c(Cl)c12

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 11/20 0.53
JAK2 O60674 1/20 0.44
RPS6KA3 P51812 1/20 0.44
MELK Q14680 1/20 0.44
STK24 Q9Y6E0 1/20 0.44
CSNK2A1 P68400 1/20 0.42
PARP1 P09874 2/20 0.38
AHR P35869 2/20 0.37
CMA1 P23946 1/20 0.37
TNF P01375 1/20 0.35
RIPK1 Q13546 1/20 0.35
TYMS P04818 1/20 0.34

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
SCHEMBL6804986 0.81 CHEK1 (0.56) CHEK1JAK2RPS6KA3MELKSTK24
SCHEMBL30727439 0.81 CHEK1 (0.56) CHEK1JAK2RPS6KA3MELKSTK24
SCHEMBL24803891 0.78 CHEK1 (0.45) CHEK1JAK2RPS6KA3MELKSTK24
SCHEMBL29701184 0.78 CHEK1 (0.45) CHEK1JAK2RPS6KA3MELKSTK24
SCHEMBL19785546 0.76
SCHEMBL15830711 0.74 CHEK1 (0.49) CHEK1JAK2RPS6KA3MELKSTK24
SCHEMBL3117561 0.73 JAK2 (0.61) CHEK1JAK2RPS6KA3MELKSTK24
SCHEMBL28870331 0.73 CHEK1 (0.51) CHEK1JAK2RPS6KA3MELKSTK24
SCHEMBL15662861 0.72 TNF (0.59) CHEK1CSNK2A1AHRCMA1TNF
SCHEMBL31058113 0.72 TNF (0.59) CHEK1CSNK2A1AHRCMA1TNF

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-4647433-A1 SHP2 INHIBITOR AND USES THEREOF Kanaph Therapeutics Inc. (KR) 2025-11-12 EP disclosed