SCHEMBL31422905

SCHEMBL31422905

COC(=O)c1cc2ccc(N(C)C(=O)OC(C)(C)C)cc2[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.39
▸ KDM4E B2RXH2 7/20 0.37
▸ GAA P10253 2/20 0.37
▸ GLA P06280 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ HSD17B10 Q99714 4/20 0.37
▸ TSHR P16473 2/20 0.37
▸ PAX8 Q06710 1/20 0.36
▸ DYRK1A Q13627 1/20 0.36
▸ DYRK1B Q9Y463 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ NOTUM Q6P988 1/20 0.34
▸ CREBBP Q92793 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ATM Q13315 1/20 0.34
▸ MPL P40238 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
SCHEMBL31422949 0.88 KDM4E (0.44) BRD4KDM4EGAAALDH1A1HSD17B10
SCHEMBL31273751 0.83 KDM4E (0.44) KDM4EGAAGLAALDH1A1HSD17B10
SCHEMBL25426199 0.77 MAOB (0.46) KDM4EGAAGLAALDH1A1HSD17B10
SCHEMBL30529282 0.77 MAOB (0.46) KDM4EGAAGLAALDH1A1HSD17B10
SCHEMBL5782935 0.77 ATR (0.42) BRD4KDM4EPAX8NOTUM
SCHEMBL31273624 0.75 KIF11 (0.49) KDM4EGAAGLAALDH1A1HSD17B10
SCHEMBL18147226 0.74 ALDH1A1 (0.43) BRD4KDM4EGAAALDH1A1HSD17B10
SCHEMBL30485169 0.74 ALDH1A1 (0.43) BRD4KDM4EGAAALDH1A1HSD17B10
SCHEMBL10330638 0.73 KDM4E (0.61) KDM4EGAAGLAALDH1A1HSD17B10
SCHEMBL24373361 0.72 CHEK1 (0.51) KDM4EGAAGLAALDH1A1HSD17B10

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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