SCHEMBL13675886

SCHEMBL13675886

CC(C)(C)c1ccc(/C=C/C(=O)Nc2cccc3cccnc23)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.66
NPC1 O15118 3/20 0.66
RAB9A P51151 3/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
LMNA P02545 2/20 0.66
KDM4E B2RXH2 4/20 0.60
RECQL P46063 2/20 0.60
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
MAPT P10636 4/20 0.59
PKM P14618 1/20 0.59
POLB P06746 3/20 0.58
TDP1 Q9NUW8 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
TNIK Q9UKE5 1/20 0.58
HDAC6 Q9UBN7 2/20 0.56
HPGD P15428 2/20 0.56
MAPK1 P28482 1/20 0.56
GLO1 Q04760 1/20 0.53
HDAC4 P56524 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
SCHEMBL29205676 0.85 KDM4E (0.73) TRPV1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL29205677 0.85 KDM4E (0.73) TRPV1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL14566085 0.83 NPC1 (0.69) TRPV1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL13675879 0.83 NPC1 (0.73) TRPV1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL13675666 0.83 MEN1 (0.67) TRPV1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL13675771 0.81 TRPV1 (0.75) TRPV1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL13762082 0.80 HDAC6 (0.73) NPC1RAB9ASMN1; SMN2LMNAKDM4E
SCHEMBL21356262 0.80 HDAC6 (0.73) NPC1RAB9ASMN1; SMN2KDM4ERECQL
SCHEMBL19631338 0.80 HDAC6 (0.73) NPC1RAB9ASMN1; SMN2KDM4ERECQL
SCHEMBL4022070 0.80 TRPV1 (1.00) TRPV1NPC1RAB9ASMN1; SMN2LMNA

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 TRPV1 1/4885NPC1 2982/4885RAB9A 1356/4885

“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.