SCHEMBL3884650

SCHEMBL3884650

O=C(Nc1ccc2cccnc2c1)c1cc2ccc(C(F)(F)F)cc2s1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
TRPV1 Q8NER1 6/20 0.48
HDAC1 Q13547 2/20 0.48
MAPT P10636 1/20 0.47
EGLN1 Q9GZT9 1/20 0.47
BRAF P15056 1/20 0.46
CHRNA7 P36544 1/20 0.46
TRPM8 Q7Z2W7 3/20 0.45
PABPC1 P11940 1/20 0.45
BAZ1A Q9NRL2 1/20 0.44
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL3882167 0.93 MEN1 (0.52) MEN1KMT2ATRPV1HDAC1MAPT
SCHEMBL3882231 0.88 POLB (0.57) MEN1KMT2ATRPV1MAPTEGLN1
SCHEMBL13863924 0.82 MEN1 (0.73) MEN1KMT2ATRPV1EGLN1BRAF
SCHEMBL31079427 0.79 HDAC1 (0.50) MEN1KMT2ATRPV1HDAC1MAPT
SCHEMBL6363197 0.76 MEN1 (0.64) MEN1KMT2ATRPV1EGLN1BRAF
SCHEMBL3879075 0.76 MEN1 (0.52) MEN1KMT2ATRPV1MAPTEGLN1
SCHEMBL4427327 0.75 MEN1 (0.73) MEN1KMT2ATRPV1PABPC1NPC1
SCHEMBL901372 0.74 CHRNA7 (0.43) CHRNA7POLB
SCHEMBL3880255 0.73 ALDH1A1 (0.57) MEN1KMT2ATRPV1MAPTEGLN1
SCHEMBL3879706 0.73 TRPV1 (0.72) MEN1KMT2ATRPV1

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-20050165049-A1 Vanilloid receptor ligands and their use in treatments AMGEN, INC. 2005-07-28 US claimed
US-7544803-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-06-09 US disclosed
US-7544803-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-06-09 US disclosed
US-7544803-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-06-09 US disclosed
US-20050165049-A1 Vanilloid receptor ligands and their use in treatments AMGEN, INC. 2005-07-28 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-20050165049-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 MEN1 3499/4885KMT2A 3902/4885TRPV1 1/4885

“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.