SCHEMBL7190813

SCHEMBL7190813

CCCCc1ccc(C(=O)OO)c(C(=O)O)c1CCCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.44
METAP2 P50579 1/20 0.44
PPARG P37231 2/20 0.42
BID P55957 5/20 0.40
MCL1 Q07820 5/20 0.40
BCL2L1 Q07817 4/20 0.40
BAK1 Q16611 4/20 0.40
KAT8 Q9H7Z6 2/20 0.40
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40
KAT2B Q92831 1/20 0.40
KAT5 Q92993 1/20 0.40
SAE1 Q9UBE0 1/20 0.40
GABRP O00591 2/20 0.38
GABRD O14764 2/20 0.38
GABRA1 P14867 2/20 0.38
GABRB1 P18505 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA5 P31644 2/20 0.38

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
SCHEMBL7190804 0.91 TYR (0.39) PPARAMETAP2PPARGBIDMCL1
SCHEMBL7190798 0.89 METAP2 (0.41) PPARAMETAP2PPARGBIDMCL1
SCHEMBL5964686 0.89 TSHR (0.44) PPARAMETAP2PPARGBIDMCL1
SCHEMBL8852388 0.89 PPARA (0.47) PPARAMETAP2PPARGBIDMCL1
Alcohol SCHEMBL11202827 0.87 PPARA (0.43) PPARAMETAP2PPARGBIDMCL1
SCHEMBL22769 0.86 BID (0.45) PPARAMETAP2PPARGBIDMCL1
SCHEMBL5150739 0.86 BID (0.45) PPARAMETAP2PPARGBIDMCL1
SCHEMBL18489486 0.86 TSHR (0.51) PPARABIDMCL1BCL2L1BAK1
SCHEMBL28115840 0.86 PPARA (0.44) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL1208160 0.85 TYR (0.41) PPARAMETAP2GABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5382626-A Formation of polyurethanes and crosslinking with vinyl groups and unsaturated polyesters MONTEDISON S.P.A. (IT) 1995-01-17 US claimed
CN-118259564-A Toner and method for producing toner 佳能株式会社 2024-06-28 CN disclosed
US-6569936-B1 Rubber composition for a conveyor belt MITSUI CHEMICALS, INC. (JP) 2003-05-27 US disclosed
EP-0877053-B1 Rubber composition for a conveyor belt MITSUI CHEMICALS INC (JP) 2001-11-14 EP disclosed
EP-0877053-A2 Rubber composition for a conveyor belt Mitsui Chemicals, Inc. (JP) 1998-11-11 EP disclosed