SCHEMBL16673149

SCHEMBL16673149

CCCC(OC(=O)CC)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 4/20 0.47
GRIA4 P48058 1/20 0.41
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.37
PPARG P37231 2/20 0.37
PPARA Q07869 2/20 0.37
GCGR P47871 1/20 0.37
SLC6A9 P48067 2/20 0.37
ESR1 P03372 1/20 0.36
HIF1A Q16665 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
FFAR1 O14842 1/20 0.36
NR1H4 Q96RI1 2/20 0.35
PRSS1 P07477 1/20 0.35
CTSG P08311 1/20 0.35
CTRB1 P17538 1/20 0.35

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
SCHEMBL16672774 0.90 UTS2R (0.44) UTS2RGRIA4LMNASMN1; SMN2PPARG
SCHEMBL16672582 0.87 UTS2R (0.42) UTS2RGRIA4LMNASMN1; SMN2PPARG
SCHEMBL16713294 0.86 UTS2R (0.45) UTS2RGRIA4LMNASMN1; SMN2PPARG
SCHEMBL1789935 0.79 GCGR (0.46) UTS2RGRIA4LMNASMN1; SMN2PPARG
SCHEMBL18253216 0.77 GRIA4 (0.43) UTS2RGRIA4LMNAGCGRSLC6A9
SCHEMBL16672537 0.75 EPHX1 (0.40) PPARGPPARAHDAC2HDAC8PRSS1
SCHEMBL1789852 0.74 UTS2R (0.42) UTS2RGRIA4LMNASMN1; SMN2SLC6A9
SCHEMBL27814464 0.74 ESR1 (0.41) LMNASMN1; SMN2ESR1HIF1AALOX15
SCHEMBL28627988 0.72 POLB (0.47) PPARGPPARAPRSS1CTSGCTRB1
SCHEMBL27903612 0.72 HSD17B3 (0.43) LMNASMN1; SMN2ESR1HIF1AALDH1A1

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
EP-2869389-B1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION CELL USING SAME MITSUBISHI CHEM CORP (JP) 2019-11-13 EP disclosed
US-10320030-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-06-11 US disclosed
US-20150140448-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2015-05-21 US disclosed
EP-2869389-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION CELL USING SAME Mitsubishi Chemical Corporation (JP) 2015-05-06 EP disclosed
US-20140107135-A1 PYRIMIDINONE INHIBITORS OF LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 AUSPEX PHARMACEUTICALS, INC. (US) 2014-04-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140107135-A1 PYRIMIDINONE INHIBITORS OF LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 PLA2G1B, PLA2G4A, PLA2G4B UTS2R 997/4885GRIA4 3353/4885LMNA 622/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.