SCHEMBL394654

SCHEMBL394654

N=C(N)c1ccc(Cc2ccc(-c3ccc(C(=N)N)cc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 5/20 0.61
PRSS3 P35030 5/20 0.61
PRSS2 P07478 4/20 0.61
F10 P00742 1/20 0.61
LOXL2 Q9Y4K0 1/20 0.61
WDR5 P61964 1/20 0.61
ALDH1A1 P00352 1/20 0.52
TOP1 P11387 1/20 0.52
HPGD P15428 1/20 0.52
NQO2 P16083 1/20 0.52
CASP1 P29466 1/20 0.52
CASP7 P55210 1/20 0.52
HSD17B10 Q99714 1/20 0.52
PRMT1 Q99873 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
F2 P00734 4/20 0.52
TMPRSS6 Q8IU80 1/20 0.52
ST14 Q9Y5Y6 1/20 0.52
CYP17A1 P05093 1/20 0.52
PLG P00747 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
SCHEMBL2717268 0.93 PRSS1 (0.70) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL394218 0.85 WDR5 (0.80) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL8973288 0.85 WDR5 (0.80) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL27680541 0.84 PRSS1 (0.69) PRSS1PRSS3PRSS2F10LOXL2
Hydrochloric Acid SCHEMBL28584052 0.83 PRSS1 (0.67) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL31490985 0.83 PRSS1 (0.57) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL397362 0.80 CYP11B1 (0.50) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL21295028 0.78 PRSS1 (0.52) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL10092625 0.77 CYP17A1 (0.52) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL537030 0.77 LMNA (0.77) PRSS1PRSS3PRSS2F10LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060293328-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents TIDWELL RICHARD R 2006-12-28 US claimed
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 claimed
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-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-20110257199-A1 NOVEL TERARYL COMPOUNDS AS ANTIPARASITIC AGENTS TIDWELL RICHARD R 2011-10-20 US disclosed
US-7964619-B2 Teraryl components as antiparasitic agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2011-06-21 US 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-20070232621-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2007-10-04 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 (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-20070232621-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents TPMT, TYMS, DDT PRSS1 3549/4885PRSS3 3974/4885PRSS2 3504/4885
US-20110257199-A1 NOVEL TERARYL COMPOUNDS AS ANTIPARASITIC AGENTS DDT, ZC3HAV1, MAVS PRSS1 2702/4885PRSS3 3421/4885PRSS2 3225/4885
US-20060293328-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents TPMT, TYMS, DDT PRSS1 3549/4885PRSS3 3974/4885PRSS2 3504/4885

“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.