SCHEMBL14243735

SCHEMBL14243735

CC(C)C/C=C/N1CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.32
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL14243736 1.00 PIK3CD (0.32) PIK3CDHSD17B10
SCHEMBL14243649 0.78
SCHEMBL14243650 0.78
Hydrochloric Acid SCHEMBL6588017 0.74 GNAI3 (0.33)
Hydrochloric Acid SCHEMBL6588013 0.74 GNAI3 (0.33)
SCHEMBL1602300 0.73 TRPA1 (0.32)
SCHEMBL3516783 0.73 PIK3CD (0.31) PIK3CD
SCHEMBL1602298 0.73 TRPA1 (0.32)
SCHEMBL13223749 0.71 MEN1 (0.33)
SCHEMBL3281200 0.70 TRPA1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2927217-B1 AMIDE COMPOUND AND PHARMACEUTICAL APPLICATION THEREFOR JAPAN TOBACCO INC (JP) 2018-01-17 EP disclosed
EP-2927217-B1 AMIDE COMPOUND AND PHARMACEUTICAL APPLICATION THEREFOR JAPAN TOBACCO INC (JP) 2018-01-17 EP disclosed
US-20160346256-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2016-12-01 US disclosed
US-20160346256-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2016-12-01 US disclosed
US-20160346256-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2016-12-01 US disclosed
US-20160137639-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2016-05-19 US disclosed
US-20160137639-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2016-05-19 US disclosed
US-20160137639-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2016-05-19 US disclosed
EP-2927217-A1 Amide compound and pharmaceutical application therefor Japan Tobacco Inc. (JP) 2015-10-07 EP disclosed
EP-2927217-A1 Amide compound and pharmaceutical application therefor Japan Tobacco Inc. (JP) 2015-10-07 EP disclosed
US-20140296306-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2014-10-02 US disclosed
US-20140296306-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2014-10-02 US disclosed
US-20140296306-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2014-10-02 US disclosed
WO-2014065413-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF 日本たばこ産業株式会社 (JP) 2014-05-01 WO disclosed
EP-2719690-A1 AMIDE COMPOUND AND PHARMACEUTICAL APPLICATION THEREFOR Japan Tobacco Inc. (JP) 2014-04-16 EP disclosed
US-8604069-B2 Amide compound and medicinal use thereof JAPAN TOBACCO INC. (JP) 2013-12-10 US disclosed
US-20120322837-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2012-12-20 US disclosed
US-20120322837-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2012-12-20 US disclosed
US-20120322837-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2012-12-20 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 (4 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-20160346256-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF SLC10A2, SLC10A1, SLC5A11 PIK3CD 2576/4885HSD17B10 1207/4885
US-20120322837-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF SLC10A2, SLC10A1, SLC5A11 PIK3CD 2576/4885HSD17B10 1207/4885
US-20140296306-A1 AMIDE COMPOUND AND MEDICINAL USE THEREOF SLC10A2, SLC10A1, SLC5A11 PIK3CD 2576/4885HSD17B10 1207/4885
US-20160137639-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF CYP3A7, CYP2C19, CYP3A5 PIK3CD 3148/4885HSD17B10 851/4885

“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.