SCHEMBL24679743

SCHEMBL24679743

Cc1nc(CO)c(C(C)C)s1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.33
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL15942761 0.81
SCHEMBL15349037 0.79 FBP1 (0.31)
SCHEMBL24116011 0.73 NLRP3 (0.33)
SCHEMBL5543974 0.73
SCHEMBL15437081 0.71 HSD17B10 (0.36) HSD17B10KDM4EALDH1A1
SCHEMBL104766 0.70 COMT (0.32) HSD17B10ALDH1A1
SCHEMBL18002772 0.70
SCHEMBL24599440 0.69 RORC (0.33) KDM4EALDH1A1
SCHEMBL11292151 0.69 NPC1 (0.30) HSD17B10ALDH1A1
SCHEMBL13145329 0.68

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-2022235575-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PETRA PHARMA CORPORATION (US) 2022-11-10 WO disclosed