SCHEMBL24670971

SCHEMBL24670971

CC(C)(C)OC(=O)NCc1ccc(NC(=O)c2nc(C3=CCN(C(=O)OC(C)(C)C)CC3)cs2)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 1/20 0.47
NAMPT P43490 3/20 0.45
KIT P10721 2/20 0.43
GPR119 Q8TDV5 2/20 0.42
GRM1 Q13255 8/20 0.42
GRM5 P41594 7/20 0.42
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PDE10A Q9Y233 1/20 0.40
JAK1 P23458 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
SCHEMBL24670988 0.86 NAMPT (0.40) WNT3ANAMPTMAPTTDP1
SCHEMBL24671008 0.84 WNT3A (0.37) WNT3ANAMPTKITMAPTTDP1
SCHEMBL24670346 0.83 NAMPT (0.48) WNT3ANAMPTKITGRM1GRM5
SCHEMBL24671070 0.83 NAMPT (0.50) WNT3ANAMPTKITGPR119GRM1
SCHEMBL24671010 0.82 WNT3A (0.37) WNT3ANAMPTKITGPR119MAPT
SCHEMBL24670226 0.82 NAMPT (0.57) WNT3ANAMPTKITGPR119MAPT
SCHEMBL24892276 0.82 NAMPT (0.57) WNT3ANAMPTKITGPR119MAPT
SCHEMBL29803758 0.81 NAMPT (0.48) WNT3ANAMPTKITGPR119GRM1
SCHEMBL24891816 0.81 NAMPT (0.47) WNT3ANAMPTKITGRM1GRM5
SCHEMBL24670337 0.80 NAMPT (0.49) WNT3ANAMPTKITGRM1GRM5

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
WO-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 WO disclosed
WO-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 WO disclosed