SCHEMBL30157712

SCHEMBL30157712

Cc1ccc(CN2C(=O)CCC2CC(=O)NC2CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.57
▸ GAA P10253 2/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ BRD4 O60885 1/20 0.43
▸ ATM Q13315 1/20 0.43

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
SCHEMBL30157807 0.90 TSHR (0.47) KMT2AGAAALDH1A1KDM4EMAPT
SCHEMBL30158819 0.87 KMT2A (0.43) KMT2AGAAALDH1A1KDM4EMAPT
SCHEMBL30157407 0.86 BRD4 (0.47) KMT2ACYP3A4CYP2C9CYP2C19BRD4
SCHEMBL30157678 0.85 KMT2A (0.60) KMT2AGAAALDH1A1KDM4EMAPT
SCHEMBL30157786 0.84 KMT2A (0.56) KMT2AGAAALDH1A1KDM4EMAPT
SCHEMBL30157782 0.84 KMT2A (0.56) KMT2AGAAALDH1A1KDM4EMAPT
SCHEMBL30157688 0.83 KMT2A (0.58) KMT2AGAAALDH1A1KDM4EMAPT
SCHEMBL30157399 0.83 KMT2A (0.55) KMT2AGAAALDH1A1KDM4EMAPT
SCHEMBL30158532 0.83 KMT2A (0.56) KMT2AGAAALDH1A1KDM4EMAPT
SCHEMBL30157940 0.82 KMT2A (0.55) KMT2AGAAALDH1A1KDM4EMAPT

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
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