SCHEMBL4158138

SCHEMBL4158138

CNc1ccc(SC(F)(F)F)c(C)c1C

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
APP P05067 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PKM P14618 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL4155338 0.85 MEN1 (0.37) MEN1ALOX15TSHRMAPK1KMT2A
SCHEMBL16707489 0.83 ALDH1A1 (0.37) ALDH1A1PKMHPGDHTTL3MBTL1
SCHEMBL4145114 0.82 MEN1 (0.32) MEN1ALOX15TSHRMAPK1KMT2A
SCHEMBL3626292 0.78 ALDH1A1 (0.40) MEN1KMT2AHSD17B10ALDH1A1PKM
SCHEMBL16707479 0.75 PDE2A (0.33) ALDH1A1
SCHEMBL13105763 0.74 TAS2R14 (0.39) MEN1ALOX15TSHRMAPK1KMT2A
SCHEMBL8095674 0.73 IDO1 (0.39) MEN1ALOX15TSHRMAPK1KMT2A
SCHEMBL4150005 0.73
SCHEMBL9367675 0.72 TRPA1 (0.37) MEN1ALOX15KMT2AHSD17B10ALDH1A1
SCHEMBL3626269 0.72 ALDH1A1 (0.39) TSHRMAPK1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090176786-A1 Benzoylurea Compounds and Use Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-07-09 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 (1 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-20090176786-A1 Benzoylurea Compounds and Use Thereof BTK, BRIX1, NFXL1 MEN1 1863/4885ALOX15 3375/4885TSHR 332/4885

“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.