SCHEMBL8087128

SCHEMBL8087128

CCCCc1cccc(C(=O)Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.51
CYP4A11 Q02928 3/20 0.51
LPL P06858 2/20 0.46
LIPG Q9Y5X9 2/20 0.46
SPHK2 Q9NRA0 1/20 0.46
SPHK1 Q9NYA1 1/20 0.46
PPARG P37231 2/20 0.46
PPARA Q07869 2/20 0.46
MAP1LC3B Q9GZQ8 1/20 0.44
MAP1LC3A Q9H492 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
RARB P10826 1/20 0.44
PLK1 P53350 1/20 0.44
XIAP P98170 1/20 0.43

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
SCHEMBL8102327 0.95 LPL (0.53) CYP4F2CYP4A11LPLLIPGSPHK2
SCHEMBL8087274 0.93 LPL (0.54) CYP4F2CYP4A11LPLLIPGSPHK2
SCHEMBL8094372 0.93 LPL (0.54) CYP4F2CYP4A11LPLLIPGSPHK2
SCHEMBL8102302 0.93 LPL (0.54) CYP4F2CYP4A11LPLLIPGSPHK2
SCHEMBL3892580 0.89 KAT6A (0.50) CYP4F2CYP4A11MAP1LC3BMAP1LC3ASMN1; SMN2
SCHEMBL11757933 0.86 CYP4F2 (0.54) CYP4F2CYP4A11LPLLIPGSPHK2
SCHEMBL8098007 0.84 CYP4F2 (0.53) CYP4F2CYP4A11LPLLIPGSPHK2
SCHEMBL8341269 0.84 CYP4F2 (0.53) CYP4F2CYP4A11LPLLIPGSPHK2
SCHEMBL31124111 0.84 FOLH1 (0.58) CYP4F2CYP4A11PPARGPPARASMN1; SMN2
SCHEMBL3387825 0.84 FOLH1 (0.58) CYP4F2CYP4A11PPARGPPARASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130172318-A1 ANTI-INFLAMMATORY AGENTS GRAINGER DAVID JOHN (GB) 2013-07-04 US disclosed
CN-103119021-A Anti-inflammatory agents CAMBRIDGE ENTPR LTD 2013-05-22 CN disclosed
EP-2580196-A1 ANTI-INFLAMMATORY AGENTS Cambridge Enterprise Ltd. (GB) 2013-04-17 EP disclosed
WO-2011154696-A1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-12-15 WO disclosed
EP-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed
EP-0041711-B1 6-CHLORO- OR 6-BROMO-1,2-DIHYDRO-3H-PYRROLO(1,2-A)-PYRROLE-1-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF, PROCESS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SYNTEX (U.S.A.) INC. (US) 1985-04-17 EP disclosed
US-4410534-A 3-Substituted-5,6,7,8-tetrahydropyrrolo[1,2-a]-pyridine-and 6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]-azepine carboxylic acid derivatives useful as blood platelet aggregation inhibitors SYNTEX (U.S.A.) INC. (US) 1983-10-18 US disclosed
US-4344943-A ANALGESICS, ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1982-08-17 US disclosed
EP-0041711-A1 6-Chloro- or 6-bromo-1,2-dihydro-3H-pyrrolo(1,2-a)-pyrrole-1-carboxylic acids and derivatives thereof, process for their production and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1981-12-16 EP 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-20130172318-A1 ANTI-INFLAMMATORY AGENTS IL6, TNF, IL1B CYP4F2 2847/4885CYP4A11 1529/4885LPL 462/4885

“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.