SCHEMBL3572818

SCHEMBL3572818

NN(Cc1ccc(OC(F)(F)C(F)F)cc1)C(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TRPM8 Q7Z2W7 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PTPN1 P18031 1/20 0.41
LPAR1 Q92633 12/20 0.40
LPAR5 Q9H1C0 12/20 0.40
PTGES2 Q9H7Z7 1/20 0.40
EPHX1 P07099 1/20 0.39
SERPINE1 P05121 1/20 0.39
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL3579626 0.79 MEN1 (0.53) MEN1KMT2ALPAR1LPAR5
SCHEMBL3577181 0.78 MEN1 (0.55) MEN1KMT2ATRPM8
SCHEMBL28152910 0.77 HSD11B1 (0.53) MEN1KMT2AALDH1A1TSHR
SCHEMBL3571440 0.76 MLYCD (0.48) MEN1KMT2ATRPM8
SCHEMBL3586090 0.76 MLYCD (0.48) MEN1KMT2ATRPM8
SCHEMBL29006698 0.72 ACHE (0.61) MEN1KMT2AALDH1A1TSHRLPAR1
SCHEMBL28730335 0.72 MLYCD (0.39) TRPM8ALDH1A1TSHRHSD17B10
SCHEMBL16923894 0.71 TRPM8 (0.78) MEN1KMT2ATRPM8EPHX1SERPINE1
SCHEMBL3575045 0.69 SERPINE1 (0.47) MEN1KMT2ATRPM8EPHX1SERPINE1
SCHEMBL850939 0.69 ALDH1A1 (0.77) KMT2AALDH1A1TSHRHSD17B10TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7678818-B2 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. (US) 2010-03-16 US disclosed
US-20070219261-A1 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. 2007-09-20 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-20070219261-A1 Anthranilamide and 2-amino-heteroarene-carboxamide compounds AADAT, AAAS, AADAC MEN1 1293/4885KMT2A 341/4885TRPM8 1917/4885

“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.