SCHEMBL13675604

SCHEMBL13675604

COc1cc(Nc2cc(-c3ccc(C(C)(C)C)cc3)ccn2)cc(OC)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAK O14976 4/20 0.56
RIPK2 O43353 3/20 0.56
COQ8A Q8NI60 3/20 0.56
NLK Q9UBE8 3/20 0.56
TGFBR1 P36897 4/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPK10 P53779 2/20 0.48
BRAF P15056 2/20 0.47
EGFR P00533 3/20 0.47
PTK2 Q05397 1/20 0.47
IGF1R P08069 3/20 0.46
EPHB6 O15197 2/20 0.46
ABL1 P00519 2/20 0.46
LCK P06239 2/20 0.46
EPHA1 P21709 2/20 0.46
EPHA8 P29322 2/20 0.46
TXK P42681 1/20 0.46
MAPK9 P45984 1/20 0.46
JAK2 O60674 1/20 0.46

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
SCHEMBL13675601 0.79 EGFR (0.53) GAKMEN1KMT2AMAPK10EGFR
SCHEMBL13675600 0.79 MAPK10 (0.50) MAPK10EGFRPIK3CA
SCHEMBL13675603 0.75 TRPV1 (0.47) MAPK10
SCHEMBL3948364 0.74 GAK (0.60) GAKRIPK2COQ8ANLKTGFBR1
SCHEMBL4717148 0.72 EGFR (0.52) GAKRIPK2COQ8ANLKTGFBR1
SCHEMBL3261684 0.71 SMN1; SMN2 (0.60) GAKRIPK2COQ8ANLKMEN1
SCHEMBL4035868 0.71 IGF1R (0.73) GAKRIPK2COQ8ANLKTGFBR1
SCHEMBL4002053 0.71 TRPV1 (0.70) MEN1KMT2A
SCHEMBL13675602 0.71 TRPV1 (0.60) MEN1KMT2AMAPK10MAPK9
SCHEMBL13675609 0.71 TRPV1 (0.72) MAPK10

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 GAK 1541/4885RIPK2 2289/4885COQ8A 2808/4885

“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.