SCHEMBL30157652

SCHEMBL30157652

O=C(NCc1ccccc1)C1CC(=O)N(c2ccc(Cl)cc2)C1

nearest known ligand 0.77

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.71
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
GAA P10253 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
SMN1; SMN2 Q16637 3/20 0.61
LMNA P02545 2/20 0.60
HTT P42858 1/20 0.60
ALOX12 P18054 1/20 0.58
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
ALDH1A1 P00352 3/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
P2RX7 Q99572 1/20 0.56

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
SCHEMBL30157451 0.95 GAA (0.67) POLBMEN1KMT2AGAATDP1
SCHEMBL30158807 0.94 GAA (0.74) POLBMEN1KMT2AGAATDP1
SCHEMBL30157665 0.91 KMT2A (0.75) POLBMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL30157604 0.88 GAA (0.68) POLBMEN1KMT2AGAATDP1
SCHEMBL30157734 0.87 GAA (0.63) POLBMEN1KMT2AGAATDP1
SCHEMBL30158025 0.85 NPSR1 (0.69) POLBMEN1KMT2AGAATDP1
SCHEMBL30157749 0.85 POLB (0.80) POLBMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL30157592 0.83 GAA (0.64) POLBMEN1KMT2AGAATDP1
SCHEMBL30157830 0.82 P2RX7 (0.72) POLBMEN1KMT2AGAATDP1
SCHEMBL30158012 0.82 MEN1 (0.68) POLBMEN1KMT2AGAATDP1

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