SCHEMBL4554299

SCHEMBL4554299

CC(=O)N/N=C1/CCc2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 11/20 0.67
HTT P42858 1/20 0.67
MAPT P10636 12/20 0.66
RAB9A P51151 10/20 0.66
NPC1 O15118 8/20 0.66
GAA P10253 4/20 0.66
KDM4E B2RXH2 1/20 0.66
TP53 P04637 1/20 0.66
TDP1 Q9NUW8 1/20 0.66
ALDH1A1 P00352 4/20 0.63
KMT2A Q03164 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
POLB P06746 1/20 0.58
LMNA P02545 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
SCHEMBL20205815 0.85 SMN1; SMN2 (0.68) SMN1; SMN2HTTMAPTRAB9ANPC1
SCHEMBL23678214 0.85 SMN1; SMN2 (0.68) SMN1; SMN2HTTMAPTRAB9ANPC1
SCHEMBL14938579 0.84 SMN1; SMN2 (0.69) SMN1; SMN2HTTMAPTRAB9ANPC1
SCHEMBL23658108 0.82 SMN1; SMN2 (0.61) SMN1; SMN2HTTMAPTRAB9ANPC1
SCHEMBL4734168 0.81 SMN1; SMN2 (0.80) SMN1; SMN2HTTMAPTRAB9ANPC1
SCHEMBL20520189 0.81 SMN1; SMN2 (0.80) SMN1; SMN2HTTMAPTRAB9ANPC1
SCHEMBL4734171 0.81 SMN1; SMN2 (0.80) SMN1; SMN2HTTMAPTRAB9ANPC1
SCHEMBL11606920 0.80 SMN1; SMN2 (0.57) SMN1; SMN2HTTMAPTRAB9ANPC1
SCHEMBL6961982 0.79 SMN1; SMN2 (0.67) SMN1; SMN2HTTMAPTRAB9ANPC1
SCHEMBL6961978 0.79 SMN1; SMN2 (0.67) SMN1; SMN2HTTMAPTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160318857-A1 N,N'-Diarylurea Compounds and N,N'-Diarylthiourea Compounds as Inhibitors of Translation Initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2016-11-03 US disclosed
US-9421211-B2 N,N′-diarylurea compounds and N,N′-diarylthiourea compounds as inhibitors of translation initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2016-08-23 US disclosed
US-20120115915-A1 N,N'-DIARYLUREA COMPOUNDS AND N,N'-DIARYLTHIOUREA COMPOUNDS AS INHIBITORS OF TRANSLATION INITIATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-05-10 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-20160318857-A1 N,N'-Diarylurea Compounds and N,N'-Diarylthiourea Compounds as Inhibitors of Translation Initiation NSUN2, EIF2AK2, RNGTT SMN1; SMN2 850/4885HTT 171/4885MAPT 1631/4885
US-20120115915-A1 N,N'-DIARYLUREA COMPOUNDS AND N,N'-DIARYLTHIOUREA COMPOUNDS AS INHIBITORS OF TRANSLATION INITIATION NSUN2, EIF2AK2, RNGTT SMN1; SMN2 850/4885HTT 171/4885MAPT 1631/4885

“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.