SCHEMBL30158635

SCHEMBL30158635

COc1ccc(CCNC(=O)CC2CCC(=O)N2Cc2ccc(C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.57
▸ KMT2A Q03164 2/20 0.53
▸ HTT P42858 1/20 0.53
▸ ALDH1A1 P00352 3/20 0.48
▸ GAA P10253 2/20 0.48
▸ TSHR P16473 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ BCHE P06276 1/20 0.47
▸ ACHE P22303 1/20 0.47

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
SCHEMBL30157966 0.93 KMT2A (0.58) POLBKMT2AHTTALDH1A1GAA
SCHEMBL30157593 0.92 KMT2A (0.52) POLBKMT2AHTTALDH1A1GAA
SCHEMBL30157842 0.90 HTT (0.51) POLBKMT2AHTTALDH1A1GAA
SCHEMBL30157585 0.89 HTT (0.58) POLBKMT2AHTTALDH1A1GAA
SCHEMBL30157767 0.89 KMT2A (0.54) POLBKMT2AHTTALDH1A1GAA
SCHEMBL30157845 0.89 HTT (0.50) POLBKMT2AHTTALDH1A1GAA
SCHEMBL30157321 0.88 KMT2A (0.53) POLBKMT2AHTTALDH1A1GAA
SCHEMBL30157373 0.87 KMT2A (0.58) POLBKMT2AALDH1A1GAATSHR
SCHEMBL30157600 0.86 KMT2A (0.51) POLBKMT2AHTTALDH1A1GAA
SCHEMBL30157475 0.85 KMT2A (0.57) POLBKMT2AHTTALDH1A1GAA

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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