SCHEMBL31423070

SCHEMBL31423070

O=C(O)c1cc2ccc(C3CCC3)c(-c3cn(-c4ccccc4)nn3)c2[nH]c1=O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 3/20 0.37
▸ MGLL Q99685 1/20 0.35
▸ DDB1 Q16531 2/20 0.35
▸ CRBN Q96SW2 2/20 0.35
▸ MIF P14174 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ HCRTR1 O43613 1/20 0.34
▸ HCRTR2 O43614 1/20 0.34
▸ KEAP1 Q14145 1/20 0.34
▸ NFE2L2 Q16236 1/20 0.34
▸ P2RY14 Q15391 2/20 0.34
▸ CAMKK1 Q8N5S9 1/20 0.33
▸ CAMKK2 Q96RR4 1/20 0.33
▸ CDC7 O00311 1/20 0.33
▸ LDHA P00338 1/20 0.33
▸ STIM1 Q13586 1/20 0.33
▸ ORAI1 Q96D31 1/20 0.33
▸ DHODH Q02127 1/20 0.33

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
SCHEMBL31423292 0.87 CAMKK1 (0.36) MGLLDDB1CRBNPARP1KEAP1
SCHEMBL31422972 0.78 CAMKK2 (0.43) CAMKK1CAMKK2DHODH
SCHEMBL31423010 0.78 CAMKK2 (0.43) CAMKK1CAMKK2DHODH
SCHEMBL31422800 0.77 CNR2 (0.36) CAMKK1CAMKK2
SCHEMBL31422933 0.77 KDM4E (0.47) —
SCHEMBL31423108 0.77 SMYD3 (0.42) CAMKK1CAMKK2
SCHEMBL31423039 0.74 CAMKK2 (0.44) CAMKK1CAMKK2DHODH
SCHEMBL31423247 0.73 CNR2 (0.40) CAMKK1CAMKK2
SCHEMBL31423082 0.72 PIK3CA (0.46) PIK3CAMIFPARP1KEAP1NFE2L2
SCHEMBL31423086 0.72 CNR2 (0.39) CAMKK1CAMKK2

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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