SCHEMBL31270863

SCHEMBL31270863

CCCc1c(Cl)c(O)c(Cl)c(O)c1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 3/20 0.45
LDHB P07195 3/20 0.45
PTPN1 P18031 3/20 0.39
PTPN11 Q06124 2/20 0.39
DPP4 P27487 1/20 0.34
JUN P05412 1/20 0.34
BID P55957 3/20 0.32
MCL1 Q07820 3/20 0.32
BCL2L1 Q07817 2/20 0.32
BAK1 Q16611 2/20 0.32
KAT8 Q9H7Z6 2/20 0.32
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
EP300 Q09472 1/20 0.32
KAT2A Q92830 1/20 0.32
KAT2B Q92831 1/20 0.32
KAT5 Q92993 1/20 0.32
SAE1 Q9UBE0 1/20 0.32
PRKCI P41743 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32

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
SCHEMBL10029771 0.86 DPP4 (0.38) LDHALDHBPTPN1PTPN11DPP4
SCHEMBL5586688 0.85 LDHA (0.49) LDHALDHBPTPN1PTPN11DPP4
SCHEMBL5586619 0.85 LDHA (0.49) LDHALDHBPTPN1PTPN11DPP4
SCHEMBL5589890 0.82 LDHA (0.50) LDHALDHBPTPN1PTPN11DPP4
SCHEMBL29405198 0.82 LDHA (0.40) LDHALDHBPTPN1PTPN11PPARG
SCHEMBL5589607 0.80 LDHA (0.51) LDHALDHBPTPN1PTPN11DPP4
SCHEMBL5588140 0.78 LDHA (0.40) LDHALDHBPTPN1PTPN11PPARG
SCHEMBL5588218 0.77 LDHA (0.37) LDHALDHBPTPN1PTPN11DPP4
SCHEMBL15841763 0.76 LDHA (0.59) LDHALDHBPTPN1PTPN11JUN
SCHEMBL5589002 0.76 LDHA (0.54) LDHALDHBPTPN1PTPN11JUN

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-119156138-A Vapor treatment of agricultural products 阿比尔技术公司 2024-12-17 CN claimed