SCHEMBL13675600

SCHEMBL13675600

CC(C)(C)c1ccc(-c2ccnc(Nc3ccccc3)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 11/20 0.50
MAPK8 P45983 8/20 0.49
GSK3B P49841 4/20 0.48
MAPK14 Q16539 3/20 0.47
KIF11 P52732 1/20 0.46
SYK P43405 1/20 0.46
MAPK13 O15264 1/20 0.45
EGFR P00533 1/20 0.45
MAPK12 P53778 1/20 0.45
KCNH2 Q12809 1/20 0.45
MAPK11 Q15759 1/20 0.45
PIP5K1B O14986 1/20 0.44
PIP5K1C O60331 1/20 0.44
PIK3CA P42336 1/20 0.44
PIP5K1A Q99755 1/20 0.44

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
SCHEMBL13151491 0.84 MAPK10 (0.62) MAPK10MAPK8MAPK14EGFRPIP5K1B
SCHEMBL13675601 0.83 EGFR (0.53) MAPK10GSK3BSYKEGFRPIK3CA
SCHEMBL13675603 0.82 TRPV1 (0.47) MAPK10GSK3BKIF11
SCHEMBL13675609 0.79 TRPV1 (0.72) MAPK10GSK3B
SCHEMBL13675604 0.79 GAK (0.56) MAPK10EGFRPIK3CA
SCHEMBL1013229 0.78 TRPV1 (0.65)
SCHEMBL1518963 0.78 MAPK10 (0.59) MAPK10MAPK8MAPK14PIP5K1BPIP5K1C
SCHEMBL12367613 0.77 ALDH1A1 (0.54) KIF11
SCHEMBL13133429 0.77 ALDH1A1 (0.54) KIF11
SCHEMBL4002053 0.77 TRPV1 (0.70) GSK3B

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 MAPK10 853/4885MAPK8 1179/4885GSK3B 1100/4885

“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.