SCHEMBL29158181

SCHEMBL29158181

O=C1C[C@@H](Cc2ccc(Cl)cc2)C(=O)N1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.65
GLA P06280 1/20 0.60
CRBN Q96SW2 4/20 0.49
DDB1 Q16531 2/20 0.49
HTT P42858 1/20 0.44
TSHR P16473 1/20 0.44
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
POLB P06746 1/20 0.43
CMA1 P23946 1/20 0.43
MAOB P27338 3/20 0.42
PPARG P37231 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL29049309 1.00 FFAR1 (0.65) FFAR1GLACRBNDDB1HTT
SCHEMBL9017825 0.85 FFAR1 (0.50) FFAR1GLACRBNDDB1KMT2A
SCHEMBL11627271 0.83 GLA (0.64) FFAR1GLACRBNDDB1HTT
SCHEMBL11270285 0.83 GLA (0.60) FFAR1GLACRBNDDB1HTT
SCHEMBL31139945 0.83 GLA (0.60) FFAR1GLACRBNDDB1HTT
SCHEMBL5767796 0.83 GLA (0.60) FFAR1GLACRBNDDB1HTT
SCHEMBL7268381 0.82 CRBN (0.70) FFAR1GLACRBNDDB1HTT
SCHEMBL29049422 0.81 FFAR1 (0.56) FFAR1GLACRBNDDB1KMT2A
SCHEMBL30526504 0.81 FFAR1 (0.56) FFAR1GLACRBNDDB1KMT2A
SCHEMBL11629119 0.79 GLA (0.59) FFAR1GLACRBNDDB1HTT

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
CN-117551018-B (R) -1-benzyl-3- (4-chlorobenzyl) pyrrolidine-2, 5-dione and preparation method and application thereof 宁夏医科大学 2024-07-16 CN disclosed
CN-117551018-A (R) -1-benzyl-3- (4-chlorophenyl) pyrrolidine-2, 5-dione and preparation method and application thereof 宁夏医科大学 2024-02-13 CN disclosed