SCHEMBL3410247

SCHEMBL3410247

CC(C)=CCC/C(C)=C/Cc1cc[c]cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
PTPN1 P18031 1/20 0.46
BACE1 P56817 1/20 0.46
GGPS1 O95749 1/20 0.46
MEN1 O00255 2/20 0.46
CYP3A4 P08684 2/20 0.46
ALOX15 P16050 2/20 0.46
MAOB P27338 3/20 0.44
MAPT P10636 3/20 0.44
ALDH1A1 P00352 1/20 0.44
UGT1A1 P22309 1/20 0.44
PPARG P37231 3/20 0.43
PTGS1 P23219 3/20 0.43
PPARA Q07869 2/20 0.43
CNR1 P21554 2/20 0.43
CNR2 P34972 2/20 0.43
TRPV1 Q8NER1 2/20 0.43
PGR P06401 1/20 0.43
HTR1A P08908 1/20 0.43
ADORA3 P0DMS8 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
SCHEMBL10794905 0.83 TRPA1 (0.38) KMT2AGGPS1MEN1CYP3A4MAOB
SCHEMBL9953748 0.82 TRPV1 (0.56) KMT2APTPN1BACE1GGPS1MEN1
SCHEMBL31670205 0.82 TRPV1 (0.56) KMT2APTPN1BACE1GGPS1MEN1
SCHEMBL793954 0.82 TRPV1 (0.56) KMT2APTPN1BACE1GGPS1MEN1
SCHEMBL5823582 0.81 PPARG (0.58) KMT2APTPN1BACE1GGPS1MEN1
SCHEMBL17867386 0.81 KMT2A (0.55) KMT2APTPN1BACE1GGPS1MEN1
SCHEMBL2072104 0.81 KMT2A (0.52) KMT2APTPN1BACE1GGPS1MEN1
SCHEMBL19664772 0.81 PPARG (0.58) KMT2APTPN1BACE1GGPS1MEN1
SCHEMBL17867387 0.81 KMT2A (0.55) KMT2APTPN1BACE1GGPS1MEN1
SCHEMBL2072101 0.81 KMT2A (0.52) KMT2APTPN1BACE1GGPS1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007503516-A 2007-02-22 JP claimed
EP-1663323-A2 COMPOSITIONS COMPRISING A DISPERSANT AND MICROCAPSULES CONTAINING AN ACTIVE MATERIAL AND A STABILIZER THE PROCTER & GAMBLE COMPANY (US) 2006-06-07 EP claimed
US-20050089540-A1 Compositions comprising a dispersant and microcapsules containing an active material and a stabilizer THE PROCTER & GAMBLE COMPANY 2005-04-28 US claimed
WO-2005025626-A2 COMPOSITIONS COMPRISING A DISPERSANT AND MICROCAPSULES CONTAINING AN ACTIVE MATERIAL AND A STABILIZER THE PROCTER & GAMBLE COMPANY (US) 2005-03-24 WO claimed
EP-3126045-B1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2020-04-29 EP disclosed
US-9790253-B2 OSW-1 analogs and conjugates, and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-10-17 US disclosed
EP-3126045-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan S.A. (CH) 2017-02-08 EP disclosed
CN-106132531-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2016-11-16 CN disclosed
EP-2926894-A1 Improvements in or relating to organic compounds Givaudan SA (CH) 2015-10-07 EP disclosed
CN-103857689-A OSW-1 analogs and conjugates, and uses thereof HARVARD COLLEGE 2014-06-11 CN disclosed
US-20140135279-A1 OSW-1 ANALOGS AND CONJUGATES, AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2014-05-15 US disclosed
US-20110319352-A1 Compounds That Bind Oxysterol Binding Proteins, and Methods of Use Thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-12-29 US disclosed
WO-2010068877-A2 COMPOUNDS THAT BIND OXYSTEROL BINDING PROTEINS, AND METHODS OF USE THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-06-17 WO disclosed
US-7226607-B2 Compositions comprising a dispersant and microcapsules containing an active material and a stabilizer THE PROCTER & GAMBLE COMPANY (US) 2007-06-05 US disclosed
EP-1663323-A2 COMPOSITIONS COMPRISING A DISPERSANT AND MICROCAPSULES CONTAINING AN ACTIVE MATERIAL AND A STABILIZER THE PROCTER & GAMBLE COMPANY (US) 2006-06-07 EP disclosed
US-20050089540-A1 Compositions comprising a dispersant and microcapsules containing an active material and a stabilizer THE PROCTER & GAMBLE COMPANY 2005-04-28 US disclosed
WO-2005025626-A2 COMPOSITIONS COMPRISING A DISPERSANT AND MICROCAPSULES CONTAINING AN ACTIVE MATERIAL AND A STABILIZER THE PROCTER & GAMBLE COMPANY (US) 2005-03-24 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 (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-20110319352-A1 Compounds That Bind Oxysterol Binding Proteins, and Methods of Use Thereof OSBP, OSBPL3, OSBP2 KMT2A 4004/4885PTPN1 4464/4885BACE1 214/4885
US-20050089540-A1 Compositions comprising a dispersant and microcapsules containing an active material and a stabilizer MLEC, ALB, MSN KMT2A 4735/4885PTPN1 2237/4885BACE1 3379/4885
US-20140135279-A1 OSW-1 ANALOGS AND CONJUGATES, AND USES THEREOF OSBP, OSBP2, OSBPL3 KMT2A 3951/4885PTPN1 2026/4885BACE1 859/4885

“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.