SCHEMBL30157721

SCHEMBL30157721

CC(C)CN1CC(C(=O)NCc2ccccc2Cl)CC1=O

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 10/20 0.78
ALDH1A1 P00352 3/20 0.59
SMN1; SMN2 Q16637 1/20 0.54
KMT2A Q03164 1/20 0.53
POLB P06746 1/20 0.52
PKM P14618 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
SCHEMBL30157684 0.88 P2RX7 (1.00) P2RX7
SCHEMBL3742340 0.88 P2RX7 (1.00) P2RX7
SCHEMBL30157273 0.85 ALDH1A1 (0.80) P2RX7ALDH1A1SMN1; SMN2KMT2APOLB
SCHEMBL30157775 0.84 P2RX7 (0.82) P2RX7ALDH1A1SMN1; SMN2KMT2APOLB
SCHEMBL3753164 0.84 P2RX7 (1.00) P2RX7
SCHEMBL30157421 0.83 P2RX7 (0.73) P2RX7ALDH1A1KMT2APOLBPKM
SCHEMBL30157938 0.83 P2RX7 (0.79) P2RX7ALDH1A1POLB
SCHEMBL30157968 0.82 P2RX7 (0.69) P2RX7ALDH1A1KMT2APOLBPKM
SCHEMBL30157952 0.80 SMN1; SMN2 (0.66) P2RX7ALDH1A1SMN1; SMN2KMT2APOLB
SCHEMBL30157497 0.80 P2RX7 (0.68) P2RX7ALDH1A1KMT2APOLB

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