SCHEMBL2511292

SCHEMBL2511292

O=C(c1ccc(F)c(F)c1F)C(O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CES2 O00748 13/20 0.65
CES1 P23141 13/20 0.65
LMNA P02545 3/20 0.52
MAPK1 P28482 1/20 0.47
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
BCHE P06276 1/20 0.36

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
SCHEMBL4935172 0.86 CES2 (0.68) CES2CES1LMNAMAPK1KDM4E
SCHEMBL18726183 0.85 CES2 (0.47) CES2CES1LMNAMAPK1KDM4E
SCHEMBL15287549 0.85 CES2 (0.50) CES2CES1LMNAMAPK1KDM4E
SCHEMBL27876515 0.85 CES2 (0.48) CES2CES1LMNAMAPK1KDM4E
SCHEMBL28833093 0.82 CES2 (0.44) CES2CES1LMNAMAPK1KDM4E
SCHEMBL31188466 0.81 CES2 (0.47) CES2CES1LMNAMAPK1KDM4E
SCHEMBL650572 0.80 CES2 (0.68) CES2CES1LMNAMAPK1KDM4E
SCHEMBL30013497 0.80 CES2 (0.68) CES2CES1LMNAMAPK1KDM4E
SCHEMBL27428737 0.77 CES2 (0.49) CES2CES1LMNAMAPK1KDM4E
SCHEMBL27913742 0.77 CES2 (0.49) CES2CES1LMNAMAPK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002067304-A1 A METHOD OF FORMING RESIST PATTERNS IN A SEMICONDUCTOR DEVICE AND A SEMICONDUCTOR WASHING LIQUID USED IN SAID METHOD HYON MAN-SOK (KR) 2002-08-29 WO claimed
US-11608347-B2 Octahydropyrido[1,2-alpha]pyrazines as MAGL inhibitors HOFFMANN-LA ROCHE INC. (US) 2023-03-21 US disclosed
US-20210024546-A1 OCTAHYDROPYRIDO[1,2-ALPHA]PYRAZINES AS MAGL INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2021-01-28 US disclosed
CN-105985354-A Pyrimidine derivative, cytotoxic agent and pharmaceutical composition and use of pyrimidine derivative 南京盖特医药技术有限公司 2016-10-05 CN disclosed
EP-2376475-A1 4-AZETIDINYL-1-HETEROARYL-CYCLOHEXANOL ANTAGONISTS OF CCR2 Janssen Pharmaceutica N.V. (BE) 2011-10-19 EP disclosed
WO-2010068663-A1 4-AZETIDINYL-1-HETEROARYL-CYCLOHEXANOL ANTAGONISTS OF CCR2 JANSSEN PHARMACEUTICA NV (BE) 2010-06-17 WO disclosed
US-20100075984-A1 DICARBONYLIC COMPOUNDS WITH ANTIBACTERIAL ACTIVITY LABORATORIOS SALVAT, S.A. (ES) 2010-03-25 US disclosed
CN-1117070-C Aryl or heteroaryl amides of tetrahydronaphthalene, chroman, thiochroman and 1,2,3,4-tetrahydroquinoline carboxylic acids having retinoid-like biological activity ALLERGAN SALES INC (US) 2003-08-06 CN disclosed
WO-2002067304-A1 A METHOD OF FORMING RESIST PATTERNS IN A SEMICONDUCTOR DEVICE AND A SEMICONDUCTOR WASHING LIQUID USED IN SAID METHOD HYON MAN-SOK (KR) 2002-08-29 WO disclosed
US-6307091-B1 TRIFLUOROMETHYLATING A TRIFLUOROIODOBENZOIC ACID ESTER WITH ADIFLUORO(FLUOROSULFONYL)ACETIC ACID ESTER IN THE PRESENCE OF A COPPER CATALYST IN AN ORGANIC SOLVENT. UBE INDUSTRIES, LTD. (JP) 2001-10-23 US disclosed
CN-1214675-A Aryl or heteroaryl amides of tetrahydronaphthalene, chroman, thiochroman and 1,2,3,4-tetrahydroquinoline carboxylic acids having retinoid-like biological activity VISION PHARM LP (US) 1999-04-21 CN 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 (3 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-20210024546-A1 OCTAHYDROPYRIDO[1,2-ALPHA]PYRAZINES AS MAGL INHIBITORS PYM1, MAG, MAGI3 CES2 1922/4885CES1 2242/4885LMNA 2143/4885
US-11608347-B2 Octahydropyrido[1,2-alpha]pyrazines as MAGL inhibitors PYM1, MAG, MAGI3 CES2 1922/4885CES1 2242/4885LMNA 2143/4885
US-20100075984-A1 DICARBONYLIC COMPOUNDS WITH ANTIBACTERIAL ACTIVITY AHR, DDC, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 CES2 2374/4885CES1 2241/4885LMNA 1869/4885

“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.