SCHEMBL13675873

SCHEMBL13675873

CSc1cccc(NC(=O)/C=C/c2ccc(C(C)(C)C)cc2)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.75
KMT2A Q03164 7/20 0.75
RAB9A P51151 7/20 0.75
NPC1 O15118 6/20 0.75
MAPT P10636 6/20 0.75
SMN1; SMN2 Q16637 6/20 0.75
ALPG P10696 1/20 0.75
NPSR1 Q6W5P4 1/20 0.74
TRPV1 Q8NER1 10/20 0.68
KDM4E B2RXH2 3/20 0.65
LMNA P02545 3/20 0.65
ALDH1A1 P00352 2/20 0.65
HTT P42858 1/20 0.65
NFKB1 P19838 1/20 0.61
NFKB2 Q00653 1/20 0.61
RELA Q04206 1/20 0.61
POLB P06746 2/20 0.59
MAPK1 P28482 2/20 0.58
HPGD P15428 1/20 0.58
TSHR P16473 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
SCHEMBL29079339 0.86 MEN1 (0.81) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL3997455 0.84 MMP1 (0.75) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL13675776 0.84 MMP1 (0.74) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL3997459 0.84 MMP1 (0.75) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL13675780 0.82 MAOB (0.72) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL13675636 0.82 TRPV1 (0.71) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL29079358 0.82 MEN1 (0.69) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL29079362 0.82 MEN1 (0.69) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL4006429 0.82 TRPV1 (1.00) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL4006434 0.82 TRPV1 (1.00) MEN1KMT2ARAB9ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264424-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. 2009-10-22 US disclosed
US-20090264424-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. 2009-10-22 US disclosed
US-7582657-B2 Treating inflammatory and neuropathic pain, headache, arthritis, rheumatic diseases, osteoarthritis, inflammatory bowel disorders, eye disorders, bladder disorders, psoriasis, skin disorders, asthma, herpes simplex AMGEN INC. (US) 2009-09-01 US disclosed
US-7582657-B2 Treating inflammatory and neuropathic pain, headache, arthritis, rheumatic diseases, osteoarthritis, inflammatory bowel disorders, eye disorders, bladder disorders, psoriasis, skin disorders, asthma, herpes simplex AMGEN INC. (US) 2009-09-01 US disclosed
US-7579347-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-08-25 US disclosed
US-7579347-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-08-25 US disclosed
EP-1780196-A2 Pyridine derivatives for use as vanilloid receptor ligands Amgen, Inc (US) 2007-05-02 EP disclosed
EP-1764358-A2 Cyclic amides as vanilloid receptor ligands and their use in treatments of inflammatory and neuropathic pain Amgen, Inc (US) 2007-03-21 EP 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-20090264424-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS TRPV1, TRPV2, TRPV3 MEN1 3504/4885KMT2A 3777/4885RAB9A 1356/4885

“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.