SCHEMBL5525474

SCHEMBL5525474

CCCc1ccc(C(=O)O)c(C(=O)O)c1CCC(C)CC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.34
PTPN11 Q06124 1/20 0.34
PRKCI P41743 1/20 0.31
CNR2 P34972 1/20 0.31
EGFR P00533 1/20 0.30
DPP4 P27487 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30
METAP2 P50579 1/20 0.30

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
SCHEMBL5525472 0.95 LDHA (0.32) PTPN1PTPN11EGFRDPP4DPP8
SCHEMBL1582331 0.94 EGFR (0.32) EGFR
SCHEMBL5528276 0.93 BID (0.35) CNR2METAP2
SCHEMBL5531085 0.92 EGFR (0.31) EGFR
SCHEMBL5528272 0.90 GABRP (0.35) CNR2DPP4METAP2
SCHEMBL5531082 0.89 EGFR (0.33) EGFR
SCHEMBL5517032 0.88 LMNA (0.32) EGFRDPP4DPP8DPP9
SCHEMBL5517030 0.85 DPP4 (0.32) EGFRDPP4DPP8DPP9
SCHEMBL5512213 0.83 KDM4E (0.31)
SCHEMBL2278213 0.83 ALDH1A1 (0.32) PTPN1PTPN11METAP2

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
US-7282601-B2 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-10-16 US disclosed
US-7271282-B1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-09-18 US disclosed