SCHEMBL4554472

SCHEMBL4554472

O=C(Nc1cccc(F)c1)Nc1ccccc1Cl

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.68
MEN1 O00255 10/20 0.68
KMT2A Q03164 10/20 0.68
RAB9A P51151 9/20 0.68
NPC1 O15118 7/20 0.68
LMNA P02545 5/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
MAPT P10636 6/20 0.66
PTGER3 P43115 1/20 0.63
POLB P06746 3/20 0.61
NPSR1 Q6W5P4 2/20 0.61
KDM4E B2RXH2 1/20 0.61
GAA P10253 1/20 0.61
MAPK1 P28482 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
GRIK1 P39086 1/20 0.61
TRPV1 Q8NER1 1/20 0.58
CASP3 P42574 2/20 0.57
SENP7 Q9BQF6 2/20 0.57
SENP8 Q96LD8 1/20 0.57

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
SCHEMBL23831728 0.85 MEN1 (0.59) KDRMEN1KMT2ARAB9ANPC1
SCHEMBL30105309 0.85 MEN1 (0.59) KDRMEN1KMT2ARAB9ANPC1
SCHEMBL6227431 0.84 MEN1 (0.74) KDRMEN1KMT2ARAB9ANPC1
SCHEMBL21751042 0.84 MEN1 (0.62) KDRMEN1KMT2ARAB9ANPC1
SCHEMBL26697226 0.84 TRPV1 (0.64) KDRMEN1KMT2ARAB9ANPC1
SCHEMBL27193042 0.83 RAB9A (0.79) MEN1KMT2ARAB9ANPC1LMNA
SCHEMBL30851500 0.83 RAB9A (0.79) MEN1KMT2ARAB9ANPC1LMNA
SCHEMBL29555990 0.83 MEN1 (0.84) MEN1KMT2ARAB9ANPC1LMNA
SCHEMBL30105275 0.83 TRPV1 (0.59) KDRMEN1KMT2ARAB9ANPC1
SCHEMBL23831708 0.83 TRPV1 (0.59) KDRMEN1KMT2ARAB9ANPC1

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-9932300-B2 N,N′-diarylurea compounds and N,N′-diarylthiourea compounds as inhibitors of translation initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2018-04-03 US disclosed
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 KDR 4697/4885MEN1 2936/4885KMT2A 761/4885
US-20120115915-A1 N,N'-DIARYLUREA COMPOUNDS AND N,N'-DIARYLTHIOUREA COMPOUNDS AS INHIBITORS OF TRANSLATION INITIATION NSUN2, EIF2AK2, RNGTT KDR 4697/4885MEN1 2936/4885KMT2A 761/4885

“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.