SCHEMBL4554274

SCHEMBL4554274

CC(C)c1ccccc1NC(=S)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.59
KDM4E B2RXH2 2/20 0.59
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
ALDH1A1 P00352 6/20 0.53
MYC P01106 1/20 0.51
MAX P61244 1/20 0.51
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.46
XBP1 P17861 2/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
S1PR3 Q99500 1/20 0.46
ULK1 O75385 1/20 0.46
POLB P06746 2/20 0.45
GAA P10253 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44

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
SCHEMBL4555506 0.82 MAPT (0.59) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL4554269 0.80 MAPT (0.57) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL23979335 0.78 MAPT (0.56) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL10221543 0.78 MAPT (0.69) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL11009249 0.77 MAPT (0.67) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL19805281 0.77 MAPT (0.57) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL21311177 0.77 RXFP1 (0.55) MAPTKDM4EALDH1A1GAANPSR1
SCHEMBL3301579 0.77 MAPT (0.75) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL1754979 0.76 MAPT (0.61) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL6724079 0.74 P2RY1 (0.54) MAPTKDM4EMEN1KMT2AALDH1A1

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 MAPT 1631/4885KDM4E 1117/4885MEN1 2936/4885
US-20120115915-A1 N,N'-DIARYLUREA COMPOUNDS AND N,N'-DIARYLTHIOUREA COMPOUNDS AS INHIBITORS OF TRANSLATION INITIATION NSUN2, EIF2AK2, RNGTT MAPT 1631/4885KDM4E 1117/4885MEN1 2936/4885

“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.