Sugi Predict

Sugi Predict / Compounds / SCHEMBL396846

SCHEMBL396846

SCHEMBL396846

N#Cc1ccc(-c2ccc(-c3ccc(C#N)cc3)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP3 P08254 1/20 0.74
▸ KIF11 P52732 3/20 0.64
▸ CA2 P00918 3/20 0.58
▸ CA12 O43570 2/20 0.58
▸ CA9 Q16790 2/20 0.58
▸ CA1 P00915 2/20 0.58
▸ CYP2A6 P11509 2/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ CA3 P07451 1/20 0.58
▸ CA6 P23280 1/20 0.58
▸ CA14 Q9ULX7 1/20 0.58
▸ CYP11B2 P19099 1/20 0.56
▸ TSHR P16473 2/20 0.56
▸ LOXL2 Q9Y4K0 1/20 0.50
▸ NOTUM Q6P988 1/20 0.50
▸ ENPP2 Q13822 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ PTPN5 P54829 1/20 0.48
▸ HDAC2 Q92769 1/20 0.47
▸ MMP2 P08253 1/20 0.47

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
SCHEMBL13063633 1.00 MMP3 (0.74) MMP3KIF11CA2CA12CA9
Water SCHEMBL11055485 1.00 MMP3 (0.74) MMP3KIF11CA2CA12CA9
SCHEMBL26246 1.00 MMP3 (0.74) MMP3KIF11CA2CA12CA9
Methane SCHEMBL28372042 0.97 MMP3 (0.70) MMP3KIF11CA2CA12CA9
SCHEMBL16789941 0.91 MMP3 (0.64) MMP3KIF11CA2CA12CA9
SCHEMBL3611983 0.91 MMP3 (0.64) MMP3KIF11CA2CA12CA9
SCHEMBL45942 0.89 CA2 (0.69) MMP3KIF11CA2CA12CA9
SCHEMBL2503454 0.89 CA2 (0.69) MMP3KIF11CA2CA12CA9
Water SCHEMBL28254092 0.89 CA2 (0.69) MMP3KIF11CA2CA12CA9
Water SCHEMBL28189314 0.89 CA2 (0.69) MMP3KIF11CA2CA12CA9

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016205405-A1 COORDINATION POLYMER NDSU RESEARCH FOUNDATION (US) 2016-12-22 — — WO claimed
WO-2016205405-A1 COORDINATION POLYMER NDSU RESEARCH FOUNDATION (US) 2016-12-22 — — WO disclosed
US-9356247-B2 Semiconductor device and method for manufacturing the same SONY CORPORATION (JP) 2016-05-31 — — US disclosed
US-8895960-B2 Electrode covering material, electrode structure and semiconductor device SONY CORPORATION (JP) 2014-11-25 — — US disclosed
US-8288764-B2 Organic electronic device, method for production thereof, and organic semiconductor molecule SONY CORPORATION (JP) 2012-10-16 — — US disclosed
US-8188121-B2 Substituted pyridines as antiparasitic AZA teraryl compounds THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2012-05-29 — — US disclosed
US-8188121-B2 Substituted pyridines as antiparasitic AZA teraryl compounds THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2012-05-29 — — US disclosed
EP-1519418-B1 SEMICONDUCTOR DEVICE AND METHOD FOR MANUFACTURING SAME SONY CORP (JP) 2012-05-02 — — EP disclosed
US-8101636-B2 Linear dicationic terphenyls and their aza analogues as antiparasitic agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2012-01-24 — — US disclosed
US-8101636-B2 Linear dicationic terphenyls and their aza analogues as antiparasitic agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2012-01-24 — — US disclosed
EP-2091077-A1 ELECTRODE COATING MATERIAL, ELECTRODE STRUCTURE AND SEMICONDUCTOR DEVICE Sony Corporation (JP) 2009-08-19 — — EP disclosed
EP-2014699-A1 Method of preparing organic porous solids and solids obtainable by this method Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2009-01-14 — — EP disclosed
EP-1949896-A2 Linear dicationic terphenyls and their aza analogues as antiparasitic agents The University of North Carolina At Chapel Hill (US) 2008-07-30 — — EP disclosed
EP-1949896-A2 Linear dicationic terphenyls and their aza analogues as antiparasitic agents The University of North Carolina At Chapel Hill (US) 2008-07-30 — — EP disclosed
US-20080012010-A1 ORGANIC ELECTRONIC DEVICE, METHOD FOR PRODUCTION THEREOF, AND ORGANIC SEMICONDUCTOR MOLECULE SONY CORPORATION (JP) 2008-01-17 — — US disclosed
US-20070232621-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2007-10-04 — — US disclosed
US-20070232621-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2007-10-04 — — US disclosed
US-7186634-B2 Method for forming metal single-layer film, method for forming wiring, and method for producing field effect transistors SONY CORPORATION (JP) 2007-03-06 — — US disclosed
US-20060293328-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents TIDWELL RICHARD R 2006-12-28 — — US disclosed
EP-1736466-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents The University of North Carolina at Chapel Hill (US) 2006-12-27 — — EP 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-20070232621-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents TPMT, TYMS, DDT MMP3 4335/4885KIF11 2481/4885CA2 3682/4885
US-20060293328-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents TPMT, TYMS, DDT MMP3 4335/4885KIF11 2481/4885CA2 3682/4885

“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.