SCHEMBL13675880

SCHEMBL13675880

Cc1cnc(NC(=O)/C=C/c2ccc(C(C)(C)C)cc2)c(Br)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
NPC1 O15118 4/20 0.56
LMNA P02545 2/20 0.56
MAPT P10636 3/20 0.53
POLB P06746 2/20 0.53
MAPK1 P28482 2/20 0.53
KDM4E B2RXH2 1/20 0.53
HPGD P15428 1/20 0.53
TRPV1 Q8NER1 12/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
TP53 P04637 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
TSHR P16473 1/20 0.47
MTOR P42345 1/20 0.47
TNIK Q9UKE5 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
SCHEMBL14529051 0.86 RAB9A (0.56) RAB9ASMN1; SMN2NPC1LMNAMAPT
SCHEMBL13675778 0.75 TRPV1 (0.70) RAB9ASMN1; SMN2NPC1LMNAMAPT
SCHEMBL20214827 0.75 NPC1 (0.63) RAB9ASMN1; SMN2NPC1LMNAMAPT
SCHEMBL13675889 0.75 RAB9A (0.70) RAB9ASMN1; SMN2NPC1LMNAMAPT
SCHEMBL13675860 0.75 RAB9A (0.70) RAB9ASMN1; SMN2NPC1LMNAMAPT
SCHEMBL10019336 0.73 CYP1A2 (0.70) RAB9ASMN1; SMN2NPC1LMNAMAPT
SCHEMBL13675775 0.73 TRPV1 (0.76) RAB9ASMN1; SMN2NPC1LMNAMAPT
SCHEMBL13675776 0.72 MMP1 (0.74) RAB9ASMN1; SMN2NPC1LMNAMAPT
SCHEMBL20213821 0.71 RAB9A (0.62) RAB9ASMN1; SMN2NPC1LMNAMAPT
SCHEMBL13675786 0.71 TRPV1 (0.57) RAB9ASMN1; SMN2NPC1LMNAMAPT

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

“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.