SCHEMBL13675829

SCHEMBL13675829

O=C(/C=C/c1ccc(Br)cc1)Nc1ccc2ncsc2c1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
RAB9A P51151 4/20 0.58
NPC1 O15118 3/20 0.58
GPR183 P32249 1/20 0.55
KCNH2 Q12809 1/20 0.55
TRPV1 Q8NER1 1/20 0.53
EGFR P00533 4/20 0.51
MCHR1 Q99705 1/20 0.51
KDM4E B2RXH2 2/20 0.48
MAOA P21397 3/20 0.48
MAOB P27338 3/20 0.48
USP30 Q70CQ3 1/20 0.47
LMNA P02545 1/20 0.46
HPSE Q9Y251 1/20 0.46
MMP1 P03956 1/20 0.45
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45

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
SCHEMBL13675632 0.85 TRPV1 (0.61) MEN1KMT2ARAB9ANPC1TRPV1
SCHEMBL13675819 0.85 MEN1 (0.60) MEN1KMT2ARAB9ANPC1TRPV1
SCHEMBL13675830 0.80 TRPV1 (0.61) MEN1KMT2ARAB9ANPC1TRPV1
SCHEMBL23510521 0.79 USP30 (0.43) MEN1KMT2ARAB9ANPC1GPR183
SCHEMBL13675792 0.79 NAMPT (0.48) MEN1KMT2ARAB9ANPC1GPR183
SCHEMBL3999015 0.78 MEN1 (0.54) MEN1KMT2ARAB9ANPC1TRPV1
SCHEMBL3999020 0.78 MEN1 (0.54) MEN1KMT2ARAB9ANPC1TRPV1
SCHEMBL4003499 0.75 TRPV1 (0.52) MEN1KMT2ARAB9ANPC1TRPV1
SCHEMBL4003503 0.75 TRPV1 (0.52) MEN1KMT2ARAB9ANPC1TRPV1
SCHEMBL4852591 0.75 USP30 (0.52) MEN1KMT2ARAB9ANPC1KDM4E

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 MEN1 3504/4885KMT2A 3777/4885RAB9A 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.