SCHEMBL30157791

SCHEMBL30157791

Cc1ccc(Cl)cc1CNC(=O)C1CC(=O)N(c2ccc(Cl)cc2)C1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.63
TDP1 Q9NUW8 1/20 0.63
ALDH1A1 P00352 5/20 0.59
P2RX7 Q99572 4/20 0.57
KMT2A Q03164 2/20 0.56
POLB P06746 2/20 0.55
BLM P54132 1/20 0.54
KDM4E B2RXH2 1/20 0.54
MAPT P10636 1/20 0.54
RECQL P46063 1/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
ALOX12 P18054 1/20 0.54
LMNA P02545 1/20 0.53

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
SCHEMBL30158578 0.96 ALDH1A1 (0.60) GAATDP1ALDH1A1P2RX7KMT2A
SCHEMBL30157793 0.92 ALDH1A1 (0.61) GAATDP1ALDH1A1KMT2APOLB
SCHEMBL30157467 0.89 GAA (0.65) GAATDP1ALDH1A1P2RX7KMT2A
SCHEMBL30157302 0.87 P2RX7 (0.72) GAATDP1ALDH1A1P2RX7KMT2A
SCHEMBL30157502 0.85 P2RX7 (0.70) GAATDP1ALDH1A1P2RX7KDM4E
SCHEMBL30157734 0.83 GAA (0.63) GAATDP1ALDH1A1P2RX7KMT2A
SCHEMBL30157512 0.83 ALDH1A1 (0.62) GAATDP1ALDH1A1P2RX7KMT2A
SCHEMBL30158807 0.83 GAA (0.74) GAATDP1ALDH1A1KMT2APOLB
SCHEMBL30158012 0.83 MEN1 (0.68) GAATDP1ALDH1A1P2RX7KMT2A
SCHEMBL30157604 0.82 GAA (0.68) GAATDP1ALDH1A1KMT2APOLB

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-2022268520-A1 USE OF SUBSTITUTED PYRROLIDINONES OR THEIR SALTS FOR INCREASING STRESS TOLERANCE OF PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2022-12-29 WO disclosed