SCHEMBL2438898

SCHEMBL2438898

CCCC(=O)C=Cc1c(C)cccc1C

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IAPP P10997 7/20 0.57
RAB9A P51151 2/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 2/20 0.40
APP P05067 2/20 0.39
F2R P25116 2/20 0.38
BACE1 P56817 3/20 0.36
MAPT P10636 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
HTT P42858 1/20 0.36
RAF1 P04049 1/20 0.35

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
SCHEMBL2473150 1.00 IAPP (0.57) IAPPRAB9AKMT2AALDH1A1APP
SCHEMBL2444205 0.85 IAPP (0.53) IAPPRAB9AKMT2AALDH1A1APP
SCHEMBL3360246 0.85 IAPP (0.53) IAPPRAB9AKMT2AALDH1A1APP
SCHEMBL2442431 0.82 IAPP (0.50) IAPPRAB9AKMT2AALDH1A1APP
SCHEMBL2442562 0.82 IAPP (0.50) IAPPRAB9AKMT2AALDH1A1APP
SCHEMBL2437375 0.81 IAPP (0.64) IAPPRAB9AALDH1A1APPMAPT
SCHEMBL2437376 0.81 IAPP (0.64) IAPPRAB9AALDH1A1APPMAPT
SCHEMBL2473767 0.81 IAPP (0.64) IAPPRAB9AALDH1A1APPMAPT
SCHEMBL2441185 0.81 IAPP (0.64) IAPPRAB9AALDH1A1APPMAPT
SCHEMBL2059378 0.75 HCAR2 (0.50) KMT2AALDH1A1KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102300550-A Perfume systems 2011-12-28 CN claimed
EP-2362765-A2 PERFUME SYSTEMS The Procter & Gamble Company (US) 2011-09-07 EP claimed
WO-2010065446-A2 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY (US) 2010-06-10 WO claimed
US-20100137178-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY 2010-06-03 US claimed
EP-2362765-B1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2020-04-08 EP disclosed
US-8431520-B2 Perfume systems THE PROCTER & GAMBLE COMPANY (US) 2013-04-30 US disclosed
US-20130012422-A1 PERFUME SYSTEMS SMETS JOHAN (BE) 2013-01-10 US disclosed
US-20100137178-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY 2010-06-03 US 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 (2 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-20130012422-A1 PERFUME SYSTEMS TRPA1, PORCN, PLIN5 IAPP 3778/4885RAB9A 3931/4885KMT2A 4626/4885
US-20100137178-A1 PERFUME SYSTEMS TRPA1, PORCN, PLIN5 IAPP 3778/4885RAB9A 3931/4885KMT2A 4626/4885

“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.