SCHEMBL15023902

SCHEMBL15023902

NCc1cccc(-c2ccc(OC(F)(F)F)c(F)c2)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 3/20 0.44
ALOX5AP P20292 1/20 0.42
FEN1 P39748 1/20 0.42
SLC7A5 Q01650 1/20 0.39
CTSK P43235 1/20 0.38
NAAA Q02083 1/20 0.38
PDE2A O00408 1/20 0.38
EPHX2 P34913 1/20 0.38
SCN9A Q15858 5/20 0.37
MPL P40238 1/20 0.36
FAAH O00519 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
PIM1 P11309 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
SCN5A Q14524 1/20 0.35
TRPA1 O75762 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL20850053 0.84 ALOX5AP (0.43) CD274ALOX5APFEN1CTSKNAAA
SCHEMBL15023299 0.83 SLC7A5 (0.39) CD274ALOX5APFEN1SLC7A5CTSK
SCHEMBL15023941 0.81 CTSK (0.41) CD274ALOX5APFEN1SLC7A5CTSK
SCHEMBL13615053 0.77 ALOX5AP (0.48) ALOX5APFEN1PDE2AEPHX2SCN9A
SCHEMBL3727318 0.77 TAAR1 (0.45) SLC7A5CTSKNAAAPDE2AEPHX2
SCHEMBL2391667 0.76 SCN9A (0.47) ALOX5APFEN1SLC7A5EPHX2SCN9A
SCHEMBL30580173 0.75 MPL (0.45) ALOX5APFEN1MPLCYP2D6
SCHEMBL4550818 0.75 MPL (0.45) ALOX5APFEN1MPLCYP2D6
Hydrochloric Acid SCHEMBL2715685 0.74 MPL (0.44) ALOX5APFEN1MPLCYP2D6
SCHEMBL20010568 0.73 FGFR2 (0.41) ALOX5APFEN1CTSKNAAAPDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096527-B2 TRPM8 antagonists and their use in treatments AMGEN INC. (US) 2015-08-04 US disclosed
US-20140171406-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2014-06-19 US disclosed
US-20140171639-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2014-06-19 US disclosed
US-8710043-B2 TRPM8 antagonists and their use in treatments AMGEN INC. (US) 2014-04-29 US disclosed
US-20130157996-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2013-06-20 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 (3 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-20140171639-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS TRPM8, TRPM7, TRPM5 CD274 4019/4885ALOX5AP 1597/4885FEN1 4798/4885
US-20140171406-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS TRPM8, TRPM7, TRPM5 CD274 4019/4885ALOX5AP 1597/4885FEN1 4798/4885
US-20130157996-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS TRPM8, TRPM7, TRPM5 CD274 4019/4885ALOX5AP 1597/4885FEN1 4798/4885

“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.