SCHEMBL6729975

SCHEMBL6729975

CCOC(=O)C=Cc1cccc(-c2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.58
DPP4 P27487 1/20 0.58
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
PTGS2 P35354 1/20 0.54
MAOB P27338 1/20 0.53
CYP3A4 P08684 1/20 0.52
AKR1B10 O60218 3/20 0.52
AKR1B1 P15121 3/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
ALOX5 P09917 1/20 0.52
CASP3 P42574 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52

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
SCHEMBL6729973 1.00 TTR (0.58) TTRDPP4CA12CA1CA2
SCHEMBL5211560 0.92 TTR (0.56) TTRDPP4CA12CA1CA2
SCHEMBL5211559 0.92 TTR (0.56) TTRDPP4CA12CA1CA2
SCHEMBL27915164 0.90 CA12 (0.67) TTRDPP4CA12CA1CA2
SCHEMBL20269220 0.89 APP (0.60) TTRPTGS2CYP3A4AKR1B10AKR1B1
SCHEMBL20269219 0.89 APP (0.60) TTRPTGS2CYP3A4AKR1B10AKR1B1
SCHEMBL27520645 0.88 TTR (0.52) TTRDPP4CA12CA1CA2
SCHEMBL27520643 0.88 TTR (0.52) TTRDPP4CA12CA1CA2
SCHEMBL4427604 0.88 TTR (0.69) TTRDPP4CA12CA1CA2
SCHEMBL4427602 0.88 TTR (0.69) TTRDPP4CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110876278-A Magnetic shielding sheet with fragrance and preparation method and application thereof 江苏金羿先磁新材料科技有限公司 2020-03-10 CN claimed
US-6677465-B2 DIHYDROXYLATION OF 3-PHENYL CINNAMATE BY OSMIUM (VIII) OXIDE CATALYSIS IN PRESENCE OF SHARPLESS LIGAND AND OXIDIZING AGENT, SELECTIVE CONVERSION OF HYDROXY IN 2 POSITION TO LEAVING GROUP, INTRAMOLECULAR SUBSTITUTION TO FORM GLYCIDE ESTER ABBOTT GMBH & CO. KG (DE) 2004-01-13 US disclosed
US-20030162982-A1 Method for the enantioselective preparation of 3,3-diphenyl-2,3-epoxy propionic acid esters ROYALTY PHARMA COLLECTION TRUST 2003-08-28 US disclosed
US-5627189-A Insecticidal 5-substituted-2,4-diaminopyrimidine derivatives FMC CORPORATION (US) 1997-05-06 US disclosed
US-5587379-A CONTROLLING INSECTS IN AGRICULTURAL CROPS FMC CORPORATION (US) 1996-12-24 US disclosed
US-5521192-A TOBACCO BUDWORM, CABBAGE LOOPER, BEET ARMYWORM FMC CORPORATION (US) 1996-05-28 US disclosed
EP-0671881-A4 INSECTICIDAL 5-SUBSTITUTED-2,4-DIAMINOPYRIMIDINE DERIVATIVES. FMC CORP (US) 1996-03-27 EP disclosed
EP-0671881-A1 INSECTICIDAL 5-SUBSTITUTED-2,4-DIAMINOPYRIMIDINE DERIVATIVES FMC CORPORATION (US) 1995-09-20 EP disclosed
WO-1994012032-A1 INSECTICIDAL 5-SUBSTITUTED-2,4-DIAMINOPYRIMIDINE DERIVATIVES FMC CORPORATION (US) 1994-06-09 WO 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-20030162982-A1 Method for the enantioselective preparation of 3,3-diphenyl-2,3-epoxy propionic acid esters ALDH3A1, HAO2, ERGIC1 TTR 3890/4885DPP4 678/4885CA12 818/4885

“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.