SCHEMBL13675982

SCHEMBL13675982

CC(C)(C)c1ccc(CCC(=O)Nc2cccc3[nH]ccc23)cc1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DHPS P49366 5/20 0.67
TRPV1 Q8NER1 7/20 0.60
MAPK1 P28482 1/20 0.44
POLB P06746 3/20 0.43
GAA P10253 2/20 0.42
CYP2C19 P33261 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
HPGDS O60760 1/20 0.42
HCAR2 Q8TDS4 1/20 0.42
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41

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
SCHEMBL29107174 0.85 TRPV1 (0.54) DHPSTRPV1MAPK1POLBHPGDS
SCHEMBL13676149 0.81 TRPV1 (0.75) TRPV1POLBCYP2C19
SCHEMBL13483893 0.80 DHPS (1.00) DHPSPOLBNR1H4
SCHEMBL13676116 0.76 TRPV1 (0.59) TRPV1MAPK1POLBGAACYP2C19
SCHEMBL13676152 0.76 POLB (0.60) TRPV1POLBGAACYP2C19HCAR2
SCHEMBL13675975 0.76 MEN1 (0.67) TRPV1HDAC3HDAC1
SCHEMBL4865185 0.76 MAPK1 (0.54) DHPSTRPV1MAPK1POLBHDAC3
SCHEMBL25120814 0.76 DHPS (0.57) DHPSTRPV1MAPK1HPGDSHDAC3
SCHEMBL13676193 0.75 ALDH1A1 (0.65) TRPV1POLBCYP2C19
SCHEMBL14566226 0.75 TRPV1 (0.57) TRPV1POLBGAACYP2C19NR1H4

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 DHPS 3666/4885TRPV1 1/4885MAPK1 1490/4885

“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.