SCHEMBL13675878

SCHEMBL13675878

CC(C)(C)c1ccc(/C=C/C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 9/20 0.67
MAPT P10636 5/20 0.66
SMN1; SMN2 Q16637 4/20 0.66
TP53 P04637 1/20 0.66
LMNA P02545 4/20 0.64
MAPK1 P28482 3/20 0.64
POLB P06746 2/20 0.64
KDM4E B2RXH2 1/20 0.64
HPGD P15428 1/20 0.64
RAB9A P51151 7/20 0.63
KMT2A Q03164 6/20 0.63
NPC1 O15118 5/20 0.63
MEN1 O00255 5/20 0.63
NPSR1 Q6W5P4 1/20 0.63
ALDH1A1 P00352 4/20 0.58
TDP1 Q9NUW8 1/20 0.58
ALOX12 P18054 1/20 0.56
TSHR P16473 1/20 0.56
MTOR P42345 1/20 0.56

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
4-Nitro-(4'-Nitro)Cinnamanilide SCHEMBL5315660 0.89 KMT2A (0.70) TRPV1MAPTSMN1; SMN2LMNAMAPK1
SCHEMBL13675641 0.85 KMT2A (0.67) TRPV1MAPTSMN1; SMN2LMNAMAPK1
SCHEMBL13675775 0.82 TRPV1 (0.76) TRPV1MAPTSMN1; SMN2TP53LMNA
SCHEMBL3021602 0.82 MMP1 (0.69) TRPV1MAPTSMN1; SMN2LMNAMAPK1
SCHEMBL13675650 0.82 MMP1 (0.77) TRPV1MAPTSMN1; SMN2TP53LMNA
SCHEMBL15306486 0.82 MMP1 (0.69) TRPV1MAPTSMN1; SMN2LMNAMAPK1
SCHEMBL13675663 0.82 TRPV1 (0.76) TRPV1MAPTSMN1; SMN2TP53LMNA
4-Nitro-Cinnamanilide SCHEMBL3021597 0.82 MAPT (0.72) TRPV1MAPTSMN1; SMN2LMNAMAPK1
SCHEMBL13675642 0.82 TRPV1 (0.65) TRPV1MAPTSMN1; SMN2TP53LMNA
SCHEMBL13675639 0.82 MAPT (0.67) TRPV1MAPTSMN1; SMN2TP53LMNA

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 TRPV1 1/4885MAPT 755/4885SMN1; SMN2 2515/4885

“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.