SCHEMBL1898019

SCHEMBL1898019

Cc1ccc(S(=O)O)cc1C1CC(C)CCC1C(C)C

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.38
TRPM8 Q7Z2W7 4/20 0.36
TRPA1 O75762 2/20 0.36
KCNA5 P22460 1/20 0.35
TRPV1 Q8NER1 5/20 0.35
EPHX1 P07099 1/20 0.35
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
CYP19A1 P11511 2/20 0.33

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
SCHEMBL4466627 1.00 OPRM1 (0.38) OPRM1TRPM8TRPA1KCNA5TRPV1
SCHEMBL1898021 1.00 OPRM1 (0.38) OPRM1TRPM8TRPA1KCNA5TRPV1
SCHEMBL657906 0.78 OPRM1 (0.38) OPRM1TRPM8TRPA1KCNA5TRPV1
SCHEMBL1898020 0.78 OPRM1 (0.38) OPRM1TRPM8TRPA1KCNA5TRPV1
SCHEMBL3964870 0.78 OPRM1 (0.38) OPRM1TRPM8TRPA1KCNA5TRPV1
SCHEMBL2529125 0.78 OPRM1 (0.38) OPRM1TRPM8TRPA1KCNA5TRPV1
SCHEMBL4466623 0.78 KCNA5 (0.38) OPRM1TRPM8TRPA1KCNA5TRPV1
SCHEMBL9065797 0.78 OPRM1 (0.38) OPRM1TRPM8TRPA1KCNA5TRPV1
SCHEMBL7757727 0.74 OPRM1 (0.45) OPRM1TRPM8TRPA1KCNA5TRPV1
SCHEMBL8498802 0.74 KCNA5 (0.46) OPRM1TRPM8TRPA1KCNA5TRPV1

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-20110251289-A1 NEW COMPOUNDS FOR THE TREATMENT OF CANCER CSIR (ZA) 2011-10-13 US disclosed
EP-2321259-A2 NEW COMPOUNDS FOR THE TREATMENT OF CANCER CSIR (ZA) 2011-05-18 EP disclosed
WO-2009147632-A2 NEW COMPOUNDS FOR THE TREATMENT OF CANCER CSIR (ZA) 2009-12-10 WO disclosed
EP-0579476-B1 Cyanoacrylate adhesives with improved cured thermal properties LOCTITE CORP (US) 1996-01-24 EP disclosed
EP-0579476-A1 Cyanoacrylate adhesives with improved cured thermal properties LOCTITE CORPORATION (US) 1994-01-19 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-20110251289-A1 NEW COMPOUNDS FOR THE TREATMENT OF CANCER DUT, BAD, TYMS OPRM1 1477/4885TRPM8 4185/4885TRPA1 4765/4885

“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.