SCHEMBL8973340

SCHEMBL8973340

CC(=N)c1ccc(-c2ccc(-c3ccc(C(=N)N)cc3)cc2)cn1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 2/20 0.56
WDR5 P61964 1/20 0.48
NQO2 P16083 7/20 0.43
ALDH1A1 P00352 1/20 0.42
TOP1 P11387 1/20 0.42
HPGD P15428 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MKNK1 Q9BUB5 2/20 0.41
MKNK2 Q9HBH9 2/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
TOP2A P11388 1/20 0.41
TOP2B Q02880 1/20 0.41
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40

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
SCHEMBL8973453 0.91 PRMT1 (0.51) PRMT1WDR5NQO2ALDH1A1TOP1
SCHEMBL8975508 0.87 PRMT1 (0.71) PRMT1WDR5NQO2ALDH1A1TOP1
SCHEMBL14369775 0.83 PRMT1 (0.50) PRMT1WDR5NQO2ALDH1A1HPGD
SCHEMBL14155399 0.82 PRMT1 (0.52) PRMT1WDR5NQO2ALDH1A1TOP1
SCHEMBL14369773 0.81 WDR5 (0.50) PRMT1WDR5NQO2ALDH1A1TOP1
SCHEMBL8973334 0.79 PRMT1 (0.59) PRMT1WDR5ALDH1A1HPGDHSD17B10
SCHEMBL24644767 0.79 WDR5 (0.52) PRMT1WDR5NQO2ALDH1A1TOP1
SCHEMBL8975885 0.79 PRMT1 (0.46) PRMT1WDR5NQO2
SCHEMBL8975569 0.78 PRMT1 (0.63) PRMT1WDR5NQO2ALDH1A1TOP1
SCHEMBL27438022 0.77 WDR5 (0.53) PRMT1WDR5NQO2ALDH1A1TOP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
US-20070232621-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2007-10-04 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-20070232621-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents TPMT, TYMS, DDT PRMT1 2351/4885WDR5 1295/4885NQO2 2112/4885
US-20110257199-A1 NOVEL TERARYL COMPOUNDS AS ANTIPARASITIC AGENTS DDT, ZC3HAV1, MAVS PRMT1 2522/4885WDR5 1227/4885NQO2 2186/4885

“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.