SCHEMBL13675992

SCHEMBL13675992

CC(C)(C)c1ccc(CCC(=O)Nc2ccc3[nH]ccc3c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.57
MAOB P27338 2/20 0.54
NOTUM Q6P988 1/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MAPT P10636 1/20 0.49
MCHR1 Q99705 6/20 0.48
MAOA P21397 2/20 0.47
NR1H4 Q96RI1 1/20 0.47
EPHX1 P07099 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 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
SCHEMBL13675977 0.91 TRPV1 (0.60) TRPV1NOTUMMCHR1MAOANR1H4
SCHEMBL13676156 0.88 MCHR1 (0.60) MAOBMCHR1
SCHEMBL12821719 0.84 RAB9A (0.61) MAOBNOTUMNPC1RAB9AMAPT
SCHEMBL13676160 0.84 MAOB (0.49) MAOBNOTUMNPC1RAB9AMAPT
SCHEMBL13676011 0.83 TRPV1 (0.56) TRPV1MAOBNPC1RAB9AMAPT
SCHEMBL13676084 0.81 TRPV1 (0.54) TRPV1MCHR1NR1H4
SCHEMBL13675972 0.81 TRPV1 (0.62) TRPV1NPC1RAB9AMAPTMCHR1
SCHEMBL13483892 0.80 NPC1 (0.71) MAOBNPC1RAB9AMAPTMAOA
SCHEMBL13675971 0.80 TRPV1 (0.58) TRPV1MAPTMCHR1NR1H4
SCHEMBL13675979 0.80 TRPV1 (0.55) TRPV1MCHR1NR1H4

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 TRPV1 1/4885MAOB 1152/4885NOTUM 4176/4885

“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.