SCHEMBL10016636

SCHEMBL10016636

CCCCCCC/C=C/C(=O)NC1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.54
EPHX2 P34913 2/20 0.54
HTT P42858 1/20 0.50
NPC1 O15118 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL15205568 1.00 EPHX1 (0.54) EPHX1EPHX2HTTNPC1MEN1
SCHEMBL692430 0.98 EPHX1 (0.51) EPHX1EPHX2MEN1ALDH1A1MAPT
SCHEMBL692429 0.98 EPHX1 (0.51) EPHX1EPHX2MEN1ALDH1A1MAPT
SCHEMBL3087847 0.88 MEN1 (0.60) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL3960853 0.88 MEN1 (0.60) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL18556750 0.87 HTT (0.61) EPHX1EPHX2HTTNPC1ALDH1A1
SCHEMBL12923999 0.87 CNR2 (0.52) EPHX1EPHX2MEN1ALDH1A1MAPT
SCHEMBL14671476 0.86 MEN1 (0.51) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL14671474 0.83 CNR1 (0.48) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL21226235 0.80 SMN1; SMN2 (0.59) EPHX1EPHX2HTTNPC1ALDH1A1

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
EP-2636666-B1 TRANS-2-DECENOIC ACID DERIVATIVE AND MEDICAMENT CONTAINING SAME NAGOYA INDUSTRIAL SCIENCE RES INSTITUTE (JP) 2018-01-10 EP disclosed
CN-103189350-B Trans-2-decenoic acid derivative and drug containing same NAGOYA INDUSTRIAL SCIENCE RESRARCH INSTITUTE (JP) 2016-04-27 CN disclosed
US-20150297562-A1 ANALGESIC NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2015-10-22 US disclosed
US-20150297562-A1 ANALGESIC NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2015-10-22 US disclosed
US-20150297562-A1 ANALGESIC NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2015-10-22 US disclosed
US-8987486-B2 Trans-2-decenoic acid derivative and pharmaceutical agent containing the same NAGOYA INDUSTRIAL SCIENCE RESEARCH INSTITUTE (JP) 2015-03-24 US disclosed
US-8987486-B2 Trans-2-decenoic acid derivative and pharmaceutical agent containing the same NAGOYA INDUSTRIAL SCIENCE RESEARCH INSTITUTE (JP) 2015-03-24 US disclosed
US-8987486-B2 Trans-2-decenoic acid derivative and pharmaceutical agent containing the same NAGOYA INDUSTRIAL SCIENCE RESEARCH INSTITUTE (JP) 2015-03-24 US disclosed
EP-2842553-A1 ANALGESIC Nippon Zoki Pharmaceutical Co., Ltd. (JP) 2015-03-04 EP disclosed
EP-2842553-A1 ANALGESIC Nippon Zoki Pharmaceutical Co., Ltd. (JP) 2015-03-04 EP disclosed
EP-2636666-A1 TRANS-2-DECENOIC ACID DERIVATIVE AND MEDICAMENT CONTAINING SAME Nagoya Industrial Science Research Institute (JP) 2013-09-11 EP disclosed
EP-2636666-A1 TRANS-2-DECENOIC ACID DERIVATIVE AND MEDICAMENT CONTAINING SAME Nagoya Industrial Science Research Institute (JP) 2013-09-11 EP disclosed
US-20130225837-A1 TRANS-2-DECENOIC ACID DERIVATIVE AND PHARMACEUTICAL AGENT CONTAINING THE SAME NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2013-08-29 US disclosed
US-20130225837-A1 TRANS-2-DECENOIC ACID DERIVATIVE AND PHARMACEUTICAL AGENT CONTAINING THE SAME NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2013-08-29 US disclosed
US-20130225837-A1 TRANS-2-DECENOIC ACID DERIVATIVE AND PHARMACEUTICAL AGENT CONTAINING THE SAME NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2013-08-29 US disclosed
CN-103189350-A Trans-2-decenoic acid derivative and drug containing same NAGOYA IND SCIENCE RES INST 2013-07-03 CN disclosed
WO-2012060396-A1 TRANS-2-DECENOIC ACID DERIVATIVE AND MEDICAMENT CONTAINING SAME 財団法人名古屋産業科学研究所 (JP) 2012-05-10 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 (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-20150297562-A1 ANALGESIC OPRK1, OPRL1, OPRD1 EPHX1 669/4885EPHX2 570/4885HTT 174/4885
US-20130225837-A1 TRANS-2-DECENOIC ACID DERIVATIVE AND PHARMACEUTICAL AGENT CONTAINING THE SAME BDNF, NTRK2, NGF EPHX1 3282/4885EPHX2 2515/4885HTT 568/4885

“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.