SCHEMBL13675770

SCHEMBL13675770

COc1ccc(NC(=O)/C=C/c2ccc(C(C)(C)C)cc2)c(C)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 7/20 0.68
MAPT P10636 6/20 0.57
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
CYP2C19 P33261 2/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
TNIK Q9UKE5 1/20 0.53
SMN1; SMN2 Q16637 6/20 0.52
TP53 P04637 1/20 0.52
THRB P10828 1/20 0.52
NPC1 O15118 5/20 0.52
RAB9A P51151 5/20 0.52
LMNA P02545 2/20 0.51
KDM4E B2RXH2 1/20 0.51
POLB P06746 1/20 0.51
HPGD P15428 1/20 0.51
MAPK1 P28482 1/20 0.51
TRPA1 O75762 1/20 0.51

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
SCHEMBL13675781 0.86 TRPV1 (0.65) TRPV1MAPTMEN1KMT2ACYP2C19
SCHEMBL9093967 0.85 SMN1; SMN2 (0.69) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL9093972 0.85 SMN1; SMN2 (0.69) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL9695838 0.81 TRPV1 (1.00) TRPV1MAPTMEN1KMT2ACYP2C19
SCHEMBL9695844 0.81 TRPV1 (1.00) TRPV1MAPTMEN1KMT2ACYP2C19
SCHEMBL13675629 0.81 TRPV1 (1.00) TRPV1MAPTMEN1KMT2ACYP2C19
SCHEMBL13675631 0.80 TRPV1 (0.80) TRPV1MAPTMEN1KMT2ACYP2C19
SCHEMBL13675779 0.80 MMP1 (0.74) TRPV1MAPTMEN1KMT2ACYP1A2
SCHEMBL13675628 0.80 TRPV1 (1.00) TRPV1MAPTMEN1KMT2ACYP2C19
SCHEMBL13352027 0.77 MMP1 (0.74) MAPTMEN1KMT2ACYP2C19CYP1A2

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 7 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

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 755/4885MEN1 3504/4885

“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.