SCHEMBL9355145

SCHEMBL9355145

C=C(C)COC(=O)C(=C)C(Cc1ccccc1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.44
PKM P14618 1/20 0.44
PTGS1 P23219 1/20 0.44
XIAP P98170 1/20 0.44
SLC7A5 Q01650 1/20 0.44
MMP8 P22894 1/20 0.43
MDM2 Q00987 1/20 0.42
CYP1A2 P05177 1/20 0.42
SRR Q9GZT4 2/20 0.41
LDHA P00338 1/20 0.41
ALDH1A1 P00352 1/20 0.40
PPARG P37231 2/20 0.40
PPARA Q07869 2/20 0.40
CPA1 P15085 2/20 0.38
CPA3 P15088 2/20 0.38
FOLH1 Q04609 1/20 0.38
CPB1 P15086 1/20 0.38
CPB2 Q96IY4 1/20 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
SCHEMBL9359414 0.85 MMP8 (0.56) PKMMMP8MDM2CYP1A2SRR
SCHEMBL9507442 0.83 ALDH1A1 (0.47) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL7086133 0.79 CYP3A4 (0.45) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL9358977 0.79 TSHR (0.50) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL6667247 0.76 MDM2 (0.60) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL165758 0.76 CYP1A2 (0.55) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL1532407 0.71 ALPI (0.61) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL27300438 0.71 ALPI (0.61) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL9833991 0.71 ALPI (0.61) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL392827 0.71 CYP1A2 (0.70) ALPIPKMPTGS1XIAPSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0242618-B1 Transparent optical article and process for preparing same NIPPON OILS & FATS CO LTD (JP) 1994-11-02 EP claimed
US-4948854-A COPOLYMER INCLUDING ITACONIC ACID DIESTER SEIKO EPSON CORPORATION (JP) 1990-08-14 US claimed
EP-0242618-A2 Transparent optical article and process for preparing same NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1987-10-28 EP claimed
EP-0242618-B1 Transparent optical article and process for preparing same NIPPON OILS & FATS CO LTD (JP) 1994-11-02 EP disclosed
US-4948854-A COPOLYMER INCLUDING ITACONIC ACID DIESTER SEIKO EPSON CORPORATION (JP) 1990-08-14 US disclosed
EP-0242618-A2 Transparent optical article and process for preparing same NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1987-10-28 EP disclosed