SCHEMBL13675860

SCHEMBL13675860

Cc1cccnc1NC(=O)/C=C/c1ccc(C(C)(C)C)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.70
NPC1 O15118 5/20 0.70
SMN1; SMN2 Q16637 5/20 0.70
LMNA P02545 2/20 0.70
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
TRPV1 Q8NER1 8/20 0.60
HPGD P15428 2/20 0.60
ALDH1A1 P00352 2/20 0.60
MAPT P10636 4/20 0.60
KDM4E B2RXH2 3/20 0.60
POLB P06746 1/20 0.60
MAPK1 P28482 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.54
TNIK Q9UKE5 1/20 0.52
TP53 P04637 1/20 0.49
CYP1A2 P05177 1/20 0.49
THRB P10828 1/20 0.47
HTT P42858 1/20 0.47
RECQL P46063 1/20 0.47

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
SCHEMBL13675883 0.80 NPC1 (0.74) RAB9ANPC1SMN1; SMN2LMNAMEN1
SCHEMBL13675779 0.79 MMP1 (0.74) RAB9ANPC1SMN1; SMN2LMNAMEN1
SCHEMBL13675879 0.79 NPC1 (0.73) RAB9ANPC1SMN1; SMN2LMNAMEN1
SCHEMBL14566085 0.79 NPC1 (0.69) RAB9ANPC1SMN1; SMN2LMNAMEN1
SCHEMBL13675886 0.77 TRPV1 (0.66) RAB9ANPC1SMN1; SMN2LMNAMEN1
SCHEMBL13675666 0.76 MEN1 (0.67) RAB9ANPC1SMN1; SMN2LMNAMEN1
SCHEMBL13675635 0.76 RAB9A (1.00) RAB9ANPC1SMN1; SMN2LMNAMEN1
SCHEMBL13675738 0.75 TRPV1 (1.00) RAB9ANPC1SMN1; SMN2LMNAMEN1
SCHEMBL13675647 0.75 TRPV1 (0.84) RAB9ANPC1SMN1; SMN2LMNAMEN1
SCHEMBL20214827 0.75 NPC1 (0.63) RAB9ANPC1SMN1; SMN2LMNAMEN1

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-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 RAB9A 1356/4885NPC1 2982/4885SMN1; SMN2 2515/4885

“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.