SCHEMBL7428452

SCHEMBL7428452

CC(C)(C)OC(=O)CN1CC(=O)N(C(CS)Cc2ccccc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 2/20 0.45
PLA2G5 P39877 2/20 0.45
CPA3 P15088 1/20 0.36
FOLH1 Q04609 1/20 0.36
ENPP2 Q13822 1/20 0.36
AKT1 P31749 2/20 0.36
CTSS P25774 2/20 0.36
LMNA P02545 1/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CTSK P43235 1/20 0.36
ALDH1A1 P00352 2/20 0.36
PKM P14618 1/20 0.36
ATM Q13315 1/20 0.35
KDM4E B2RXH2 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRL1 P41146 1/20 0.35
SCN9A Q15858 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
HRH4 Q9H3N8 1/20 0.34

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
SCHEMBL7428787 0.84 KMT2A (0.45) CPA3FOLH1ENPP2LMNAALDH1A1
SCHEMBL7428456 0.81 PLA2G10 (0.45) PLA2G10PLA2G5ENPP2CTSSCTSK
SCHEMBL7445692 0.81 ENPP2 (0.36) CPA3FOLH1ENPP2LMNAALDH1A1
SCHEMBL7432640 0.78 ENPP2 (0.47) CPA3FOLH1ENPP2ALDH1A1PKM
SCHEMBL7440464 0.78 FOLH1 (0.41) CPA3FOLH1ALDH1A1PKM
SCHEMBL7426519 0.78 MME (0.42) CPA3FOLH1ENPP2ALDH1A1PKM
SCHEMBL7435994 0.76 MME (0.41) CPA3FOLH1ENPP2ALDH1A1PKM
SCHEMBL7737652 0.74 PLA2G10 (0.50) PLA2G10PLA2G5ALDH1A1KDM4EOPRM1
SCHEMBL7446522 0.73 CPA3 (0.44) CPA3FOLH1ALDH1A1PKM
SCHEMBL7442303 0.71 ALDH1A1 (0.53) CPA3FOLH1LMNAALDH1A1PKM

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
EP-0640594-A1 Hydantoin derivative as metalloprotease inhibitor FUJIREBIO INC. (JP) 1995-03-01 EP disclosed