SCHEMBL31339936

SCHEMBL31339936

Nc1ccc(-n2c(=O)c(C(=O)O)cc3ccc(C(F)(F)F)nc32)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 7/20 0.43
SYK P43405 3/20 0.34
CYP3A4 P08684 1/20 0.34
NFKB1 P19838 1/20 0.34
PMP22 Q01453 1/20 0.34
NOTUM Q6P988 1/20 0.34
TAS2R14 Q9NYV8 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
SCHEMBL24596271 0.80 MAT2A (0.54) MAT2ACYP3A4NFKB1PMP22
SCHEMBL29790002 0.80 MAT2A (0.54) MAT2ACYP3A4NFKB1PMP22
SCHEMBL31339862 0.79 SYK (0.38) MAT2ASYK
SCHEMBL31339930 0.77 MAT2A (0.37) MAT2ASYKTAS2R14
SCHEMBL24596318 0.75 MAT2A (0.53) MAT2A
SCHEMBL26121301 0.75 MAT2A (0.47) MAT2A
SCHEMBL31042367 0.75 MAT2A (0.47) MAT2A
SCHEMBL31339926 0.75 MAT2A (0.41) MAT2ASYKTAS2R14
SCHEMBL31339894 0.74 SYK (0.39) MAT2ASYKTAS2R14
SCHEMBL31339858 0.74 THRB (0.41) MAT2ASYKNOTUMTAS2R14

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-4501912-A1 NOVEL HETEROCYCLIC COMPOUND Shouyao Holdings (Beijing) Co., Ltd. (CN) 2025-02-05 EP disclosed