SCHEMBL30157421

SCHEMBL30157421

CC(C)CN1CC(C(=O)NCc2ccc(Cl)cc2)CC1=O

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 5/20 0.73
ALDH1A1 P00352 4/20 0.64
KMT2A Q03164 3/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
POLB P06746 1/20 0.53
MEN1 O00255 1/20 0.52
GAA P10253 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PKM P14618 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL30157634 0.88 ALDH1A1 (0.81) P2RX7ALDH1A1KMT2APOLBMEN1
SCHEMBL30157273 0.88 ALDH1A1 (0.80) P2RX7ALDH1A1KMT2APOLBMEN1
SCHEMBL30157968 0.88 P2RX7 (0.69) P2RX7ALDH1A1KMT2APOLBMEN1
SCHEMBL30157497 0.87 P2RX7 (0.68) P2RX7ALDH1A1KMT2APOLBMEN1
SCHEMBL30157334 0.86 ALDH1A1 (0.62) P2RX7ALDH1A1KMT2AL3MBTL1
SCHEMBL30157631 0.86 P2RX7 (0.61) P2RX7ALDH1A1KMT2APOLBMEN1
SCHEMBL30157684 0.84 P2RX7 (1.00) P2RX7
SCHEMBL3742340 0.84 P2RX7 (1.00) P2RX7
SCHEMBL30157938 0.84 P2RX7 (0.79) P2RX7ALDH1A1POLBL3MBTL1
SCHEMBL30157721 0.83 P2RX7 (0.78) P2RX7ALDH1A1KMT2APOLBPKM

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