SCHEMBL5675719

SCHEMBL5675719

COCNC(=O)C1CC1c1cccc(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.51
LMNA P02545 1/20 0.48
TRPM5 Q9NZQ8 4/20 0.46
ALDH1A1 P00352 3/20 0.44
HTT P42858 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
NAMPT P43490 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
MDM2 Q00987 3/20 0.43
TP53 P04637 2/20 0.43
DGAT2 Q96PD7 1/20 0.43

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
SCHEMBL5675819 0.85 ALDH1A1 (0.45) ALDH1A1SIGMAR1DGAT2
SCHEMBL5675747 0.84 ALDH1A1 (0.49) SLC9A1LMNAALDH1A1NAMPTTP53
SCHEMBL5752830 0.81 SLC9A1 (0.58) SLC9A1LMNATRPM5ALDH1A1HTT
SCHEMBL1224732 0.81 ALDH1A1 (0.67) SLC9A1LMNATRPM5ALDH1A1HTT
SCHEMBL30715031 0.81 SLC9A1 (0.58) SLC9A1LMNATRPM5ALDH1A1HTT
SCHEMBL1224730 0.81 ALDH1A1 (0.67) SLC9A1LMNATRPM5ALDH1A1HTT
SCHEMBL5752833 0.81 SLC9A1 (0.58) SLC9A1LMNATRPM5ALDH1A1HTT
SCHEMBL29302528 0.81 SLC9A1 (0.58) SLC9A1LMNATRPM5ALDH1A1HTT
SCHEMBL20380102 0.77 ALDH1A1 (0.52) LMNAALDH1A1HTTNAMPTSIGMAR1
SCHEMBL326946 0.76 SLC9A1 (0.49) SLC9A1ALDH1A1TDP1SIGMAR1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7144881-B2 Arylcyclopropylcarboxylic amides as potassium channel openers BRISTOL-MYERS SQUIBB COMPANY (US) 2006-12-05 US disclosed
EP-1565190-A4 ARYLCYCLOPROPYLCARBOXYLIC AMIDES AS POTASSIUM CHANNEL OPENERS BRISTOL MYERS SQUIBB CO (US) 2006-04-26 EP disclosed
EP-1565190-A2 ARYLCYCLOPROPYLCARBOXYLIC AMIDES AS POTASSIUM CHANNEL OPENERS Bristol-Myers Squibb Company (US) 2005-08-24 EP disclosed
US-20040110754-A1 2-(2-fluoro-phenyl)-cyclopropanecarboxylic acid[1-(2,3-dihydro-benzofuran-5-yl)-ethyl]-amide for example; for pain, migraine, neuropathic pain, bipolar disorders, convulsions, mania, epilepsy, anxiety, depression and neurodegenerative disorders BRISTOL-MYERS SQUIBB COMPANY 2004-06-10 US disclosed
WO-2004047738-A2 ARYLCYCLOPROPYLCARBOXYLIC AMIDES AS POTASSIUM CHANNEL OPENERS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-06-10 WO 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-20040110754-A1 2-(2-fluoro-phenyl)-cyclopropanecarboxylic acid[1-(2,3-dihydro-benzofuran-5-yl)-ethyl]-amide for example; for pain, migraine, neuropathic pain, bipolar disorders, convulsions, mania, epilepsy, anxiety, depression and neurodegenerative disorders KCNQ2, KCNQ5, KCNJ2 SLC9A1 403/4885LMNA 1089/4885TRPM5 95/4885

“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.