SCHEMBL13675994

SCHEMBL13675994

COC(=O)c1ccc(NC(=O)CCc2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.64
CA2 P00918 1/20 0.64
NR1H4 Q96RI1 3/20 0.62
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
TRPV1 Q8NER1 1/20 0.57
LMNA P02545 4/20 0.55
MAPT P10636 3/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HPGD P15428 2/20 0.54
NAMPT P43490 1/20 0.54
MAPK1 P28482 1/20 0.53
ALDH1A1 P00352 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
KDM4E B2RXH2 1/20 0.51
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50

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
SCHEMBL13675965 0.85 NR1H4 (0.64) NR1H4MEN1KMT2ATRPV1LMNA
SCHEMBL13675953 0.85 KMT2A (0.62) NR1H4MEN1KMT2ATRPV1LMNA
SCHEMBL5284400 0.85 ALDH1A1 (0.58) CA1CA2NR1H4TRPV1LMNA
SCHEMBL13676146 0.83 TRPV1 (0.62) NR1H4MEN1KMT2ATRPV1MAPT
SCHEMBL13676192 0.83 TRPV1 (0.62) NR1H4TRPV1MAPTRAB9AHDAC3
SCHEMBL13675963 0.83 TRPV1 (0.62) NR1H4TRPV1MAPTRAB9AHDAC3
SCHEMBL13675964 0.83 TRPV1 (0.62) NR1H4TRPV1MAPTHDAC3HDAC4
SCHEMBL2839287 0.83 RAB9A (0.74) CA1CA2MEN1KMT2ALMNA
SCHEMBL13676000 0.83 TRPV1 (0.62) NR1H4MEN1KMT2ATRPV1MAPT
SCHEMBL13676145 0.82 TRPV1 (0.60) NR1H4TRPV1HDAC3HDAC4HDAC1

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 6 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

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 CA1 2759/4885CA2 923/4885NR1H4 290/4885

“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.