SCHEMBL13675593

SCHEMBL13675593

CCOC(=O)/C=C(\CCCn1ccnc1)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
TBXAS1 P24557 3/20 0.50
POLB P06746 2/20 0.50
SMN1; SMN2 Q16637 5/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HTT P42858 3/20 0.45
LMNA P02545 2/20 0.45
ALDH1A1 P00352 2/20 0.45
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPK1 P28482 2/20 0.42

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
SCHEMBL13675595 0.86 KMT2A (0.52) KMT2AMEN1TBXAS1POLBSMN1; SMN2
SCHEMBL13675591 0.81 TRPV1 (0.44) KMT2AMEN1POLBSMN1; SMN2TDP1
SCHEMBL10926670 0.79 TBXAS1 (0.62) KMT2AMEN1TBXAS1POLBSMN1; SMN2
SCHEMBL13675592 0.78 TRPV1 (0.43) KMT2AMEN1POLBSMN1; SMN2TDP1
SCHEMBL13675590 0.74 TRPV1 (0.44) KMT2AMEN1POLBSMN1; SMN2TDP1
SCHEMBL13675588 0.74 TRPV1 (0.69) KMT2AMEN1SMN1; SMN2MAPTTSHR
SCHEMBL3998318 0.73 NTRK1 (0.47) KMT2AMEN1POLBSMN1; SMN2CYP1A2
SCHEMBL3998323 0.73 QPCT (0.51) KMT2AMEN1POLBSMN1; SMN2CYP1A2
SCHEMBL3998321 0.73 NTRK1 (0.47) KMT2AMEN1POLBSMN1; SMN2CYP1A2
SCHEMBL13675849 0.73 TRPV1 (0.46) KMT2AMEN1POLBSMN1; SMN2CYP1A2

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-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 KMT2A 3777/4885MEN1 3504/4885TBXAS1 1160/4885

“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.