SCHEMBL4427327

SCHEMBL4427327

CC(C)(C)c1ccc(C(=O)Nc2ccc3cccnc3c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.73
KMT2A Q03164 3/20 0.73
TRPV1 Q8NER1 10/20 0.68
NPC1 O15118 3/20 0.62
RAB9A P51151 3/20 0.62
POLB P06746 1/20 0.62
PABPC1 P11940 2/20 0.59
NAMPT P43490 1/20 0.57
EIF4H Q15056 1/20 0.57

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
SCHEMBL13762079 0.90 NPC1 (0.77) MEN1KMT2ATRPV1NPC1RAB9A
SCHEMBL13863924 0.87 MEN1 (0.73) MEN1KMT2ATRPV1NPC1RAB9A
SCHEMBL7101847 0.85 PABPC1 (0.79) MEN1KMT2ATRPV1NPC1RAB9A
SCHEMBL3890282 0.84 MEN1 (1.00) MEN1KMT2ATRPV1NPC1RAB9A
SCHEMBL13998319 0.84 MEN1 (0.76) MEN1KMT2ATRPV1NPC1RAB9A
SCHEMBL13863923 0.84 MEN1 (0.71) MEN1KMT2ATRPV1NPC1RAB9A
SCHEMBL4428905 0.83 TRPV1 (0.76) MEN1KMT2ATRPV1NPC1RAB9A
SCHEMBL3878438 0.83 MEN1 (0.74) MEN1KMT2ATRPV1NPC1RAB9A
SCHEMBL4433847 0.82 MEN1 (0.73) MEN1KMT2ATRPV1NPC1RAB9A
SCHEMBL13675738 0.81 TRPV1 (1.00) MEN1KMT2ATRPV1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538121-B2 Vanilloid receptor modulators GLAXO GROUP LIMITED (GB) 2009-05-26 US disclosed
US-7538121-B2 Vanilloid receptor modulators GLAXO GROUP LIMITED (GB) 2009-05-26 US disclosed
US-7538121-B2 Vanilloid receptor modulators GLAXO GROUP LIMITED (GB) 2009-05-26 US disclosed
EP-2033953-A1 Vanilloid receptor modulators Glaxo Group Limited (GB) 2009-03-11 EP disclosed
EP-2033953-A1 Vanilloid receptor modulators Glaxo Group Limited (GB) 2009-03-11 EP disclosed
US-20060142333-A1 Vanilloid receptor modulators MACDONALD GREGOR J 2006-06-29 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-20060142333-A1 Vanilloid receptor modulators TRPV1, NPSR1, TRPV3 MEN1 3527/4885KMT2A 3992/4885TRPV1 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.