SCHEMBL31422800

SCHEMBL31422800

O=C(O)c1cc2ccc(C3CCC3)c(-c3cc[nH]n3)c2[nH]c1=O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 3/20 0.36
▸ KDM5A P29375 2/20 0.34
▸ KDM5B Q9UGL1 2/20 0.34
▸ HCAR2 Q8TDS4 1/20 0.34
▸ CAMKK2 Q96RR4 6/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ CAMKK1 Q8N5S9 2/20 0.33
▸ HPGD P15428 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ IKBKE Q14164 1/20 0.31
▸ TBK1 Q9UHD2 1/20 0.31
▸ PDK2 Q15119 1/20 0.30
▸ PDK4 Q16654 1/20 0.30
▸ UCHL1 P09936 1/20 0.30

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
SCHEMBL31422904 0.80 MEN1 (0.35) CNR2
SCHEMBL31423292 0.79 CAMKK1 (0.36) HCAR2CAMKK2ALDH1A1CAMKK1
SCHEMBL31423247 0.78 CNR2 (0.40) CNR2KDM5AKDM5BHCAR2CAMKK2
SCHEMBL31423070 0.77 PIK3CA (0.37) CAMKK2CAMKK1
SCHEMBL31423010 0.77 CAMKK2 (0.43) CAMKK2KDM4EPOLBCAMKK1
SCHEMBL31422972 0.77 CAMKK2 (0.43) CAMKK2KDM4EPOLBCAMKK1
SCHEMBL31423086 0.77 CNR2 (0.39) CNR2KDM5AKDM5BCAMKK2KDM4E
SCHEMBL31422933 0.76 KDM4E (0.47) KDM4EALDH1A1HPGD
SCHEMBL31423108 0.76 SMYD3 (0.42) CAMKK2KDM4EALDH1A1POLBGAA
SCHEMBL31422779 0.74 CNR2 (0.42) CNR2CAMKK2KDM4EALDH1A1POLB

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-2025085233-A1 NOVEL DERIVATIVES OF QUINOLINONES, AND COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2025-04-24 — — WO disclosed
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