SCHEMBL31360877

SCHEMBL31360877

CC(=O)c1ccccc1-c1cc(OCCCCl)ccc1C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.45
▸ LMNA P02545 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ MAOB P27338 11/20 0.42
▸ PPARD Q03181 1/20 0.41
▸ PARP10 Q53GL7 1/20 0.40
▸ MAOA P21397 3/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL3080356 0.76 THRA (0.47) L3MBTL1PPARDPARP10SMN1; SMN2
SCHEMBL7806602 0.74 PDK2 (0.46) PARP10
SCHEMBL7369218 0.74 PPARD (0.69) MAOBPPARDMAOA
SCHEMBL5262606 0.74 L3MBTL1 (0.50) L3MBTL1MAOBPPARDMAOA
SCHEMBL5260336 0.73 MAOB (0.62) MAOBPPARDMAOA
SCHEMBL3079256 0.73 PARP10 (0.58) MAOBPPARDPARP10MAOA
SCHEMBL1373516 0.72 LMNA (0.50) LMNAMAPTL3MBTL1MAOBPPARD
SCHEMBL5110958 0.69 KDM4E (0.54) MAPTSMN1; SMN2
SCHEMBL28339943 0.69 LMNA (0.68) PTPN11LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL18480026 0.69 MAOB (0.51) LMNAMAPTL3MBTL1MAOBPPARD

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
CN-114599362-B Application of phenylquinolinone and flavonoid derivatives in preparation of medicines for treating neuropathic pain 杭州百诚医药科技股份有限公司 2025-02-11 — — CN disclosed
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