SCHEMBL24600251

SCHEMBL24600251

N#Cc1cccc(-n2cc(Oc3c(Cl)cc(-n4nc(C#N)c(=O)[nH]c4=O)cc3Cl)ccc2=O)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 16/20 0.51
▸ THRB P10828 16/20 0.51
▸ CYP2C8 P10632 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ NPBWR1 P48145 1/20 0.43
▸ MCHR1 Q99705 1/20 0.43
▸ NPC1 O15118 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ BCAT1 P54687 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ OPRK1 P41145 1/20 0.36

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
SCHEMBL28664590 0.93 THRB (0.52) THRATHRBCYP2C8CYP2C9NPC1
SCHEMBL24600247 0.91 THRB (0.54) THRATHRBCYP2C8CYP2C9NPC1
SCHEMBL24600250 0.90 THRA (0.50) THRATHRBCYP2C8CYP2C9NPC1
SCHEMBL24600238 0.90 THRA (0.52) THRATHRBCYP2C8CYP2C9NPBWR1
SCHEMBL24600346 0.88 THRA (0.48) THRATHRBCYP2C8CYP2C9NPBWR1
SCHEMBL24600355 0.88 THRA (0.48) THRATHRBCYP2C8CYP2C9NPC1
SCHEMBL24600270 0.88 THRB (0.49) THRATHRBCYP2C8CYP2C9NPC1
SCHEMBL24600362 0.86 THRA (0.54) THRATHRBCYP2C8CYP2C9NPC1
SCHEMBL24600240 0.86 THRB (0.52) THRATHRBCYP2C8CYP2C9NPC1
SCHEMBL24600350 0.86 THRA (0.54) THRATHRBCYP2C8CYP2C9NPBWR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4273139-A1 2-PYRIDONE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL APPLICATION THEREOF KPC Pharmaceuticals, Inc. (CN) 2023-11-08 — — EP disclosed
WO-2022143574-A1 2-PYRIDONE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL APPLICATION THEREOF 昆药集团股份有限公司 2022-07-07 — — WO disclosed
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