SCHEMBL29005164

SCHEMBL29005164

O=C(O)NC(CNC(=O)OCc1ccccc1)C(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.49
TP53 P04637 1/20 0.49
SLC6A9 P48067 4/20 0.46
PPARA Q07869 2/20 0.45
SLC6A5 Q9Y345 3/20 0.45
HTT P42858 1/20 0.43
CTSS P25774 4/20 0.43
CTSL P07711 3/20 0.43
CTSB P07858 2/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
PSMB1 P20618 1/20 0.42
PSMB5 P28074 1/20 0.42
PSMB2 P49721 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL30342202 0.88 SYK (0.53) CTSKTP53PPARACTSSCTSL
SCHEMBL30342183 0.87 CTSK (0.48) CTSKTP53SLC6A9PPARASLC6A5
SCHEMBL30345149 0.85 TP53 (0.50) CTSKTP53SLC6A9PPARASLC6A5
Hydrochloric Acid SCHEMBL29005181 0.84 TP53 (0.49) CTSKTP53SLC6A9PPARASLC6A5
SCHEMBL2011885 0.79 SLC6A9 (0.70) TP53SLC6A9SLC6A5HTTSMN1; SMN2
SCHEMBL7329157 0.73 CTSK (0.58) CTSKPPARACTSSCTSLCTSB
SCHEMBL1191975 0.73 CTSK (0.58) CTSKPPARACTSSCTSLCTSB
SCHEMBL24130315 0.72 CTSK (0.58) CTSKCTSSCTSLCTSB
SCHEMBL24130316 0.72 CTSK (0.58) CTSKCTSSCTSLCTSB
Benzyl Benzoate SCHEMBL30345166 0.72 KMT2A (0.44) CTSKTP53SLC6A9SLC6A5LMNA

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-116134018-A 2-oxoimidazolidine-4-carboxamide as NAV1.8 inhibitor 默沙东有限责任公司 2023-05-16 CN disclosed