SCHEMBL13675972

SCHEMBL13675972

CC(C)(C)c1ccc(CCC(=O)Nc2ccc3ccccc3c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.62
CYP1A2 P05177 2/20 0.57
LMNA P02545 2/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
NPC1 O15118 1/20 0.56
MCHR1 Q99705 5/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ALDH1A1 P00352 2/20 0.55
CYP2C19 P33261 2/20 0.55
KDM4E B2RXH2 1/20 0.55
HIF1A Q16665 1/20 0.55
MAPT P10636 3/20 0.54
HPGD P15428 1/20 0.54
HTT P42858 1/20 0.54
GAA P10253 3/20 0.54
POLB P06746 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
PLAU P00749 1/20 0.52

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
SCHEMBL28549583 0.85 CYP1A2 (0.72) CYP1A2LMNARAB9ASMN1; SMN2NPC1
SCHEMBL13676043 0.84 MAPT (0.71) TRPV1LMNARAB9AKMT2AALDH1A1
SCHEMBL20625313 0.84 MAPT (0.71) TRPV1LMNARAB9AMEN1KMT2A
SCHEMBL13675946 0.83 TRPV1 (0.61) TRPV1MCHR1MEN1KMT2APLAU
SCHEMBL13675957 0.83 MCHR1 (0.57) TRPV1CYP1A2RAB9ANPC1MCHR1
SCHEMBL846968 0.82 TRPV1 (0.67) TRPV1LMNARAB9AMEN1KMT2A
SCHEMBL13676188 0.82 TRPV1 (0.65) TRPV1LMNAMCHR1KMT2AALDH1A1
SCHEMBL17069875 0.81 HDAC1 (0.70) TRPV1RAB9ACYP2C19MAPTHTT
SCHEMBL13675992 0.81 TRPV1 (0.57) TRPV1RAB9ANPC1MCHR1MAPT
SCHEMBL13676154 0.81 RAB9A (0.65) TRPV1LMNARAB9ASMN1; SMN2ALDH1A1

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 1/4885CYP1A2 2153/4885LMNA 3886/4885

“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.