SCHEMBL24670672

SCHEMBL24670672

Cc1cc(C2=CCN(C(=NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)CC2)ccc1C=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 8/20 0.41
QDPR P09417 2/20 0.36
SOS1 Q07889 2/20 0.36
PRMT5 O14744 2/20 0.35
WDR77 Q9BQA1 2/20 0.35
CDK7 P50613 1/20 0.34
CDK13 Q14004 1/20 0.34
CDK12 Q9NYV4 1/20 0.34
LIPC P11150 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
GRM5 P41594 1/20 0.34
GRM1 Q13255 1/20 0.34
KIT P10721 1/20 0.34
PDK4 Q16654 1/20 0.33
WNT3A P56704 1/20 0.33

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
SCHEMBL24670659 1.00 NAMPT (0.41) NAMPTQDPRSOS1PRMT5WDR77
SCHEMBL24670115 0.90 NAMPT (0.43) NAMPTQDPRSOS1PRMT5WDR77
SCHEMBL24671208 0.88 NAMPT (0.40) NAMPTQDPRSOS1PRMT5WDR77
SCHEMBL24669354 0.87 NAMPT (0.42) NAMPTQDPRSOS1PRMT5WDR77
SCHEMBL24669928 0.87 NAMPT (0.44) NAMPTQDPRPRMT5WDR77CDK7
SCHEMBL24670584 0.86 NAMPT (0.42) NAMPTQDPRSOS1PRMT5WDR77
SCHEMBL24891831 0.86 NAMPT (0.43) NAMPTWNT3A
SCHEMBL24670022 0.85 NAMPT (0.42) NAMPTQDPRSOS1PRMT5WDR77
SCHEMBL24670320 0.83 NAMPT (0.39) NAMPTQDPRSOS1PRMT5WDR77
SCHEMBL27025886 0.83 NAMPT (0.39) NAMPTQDPRSOS1PRMT5WDR77

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-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