SCHEMBL2327014

SCHEMBL2327014

CC(C(=O)NC(CS(=O)(=O)O)C(=O)O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 12/20 0.49
GPR88 Q9GZN0 2/20 0.45
ACE P12821 2/20 0.43
PTGS2 P35354 1/20 0.42
PRSS1 P07477 1/20 0.42
TMPRSS15 P98073 1/20 0.42
CPA1 P15085 1/20 0.42
ACE2 Q9BYF1 1/20 0.42

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
SCHEMBL2327018 1.00 MME (0.49) MMEGPR88ACEPTGS2PRSS1
SCHEMBL2332191 0.89 ACE (0.43) MMEACEPRSS1TMPRSS15
SCHEMBL2323705 0.86 MME (0.54) MMEGPR88
SCHEMBL13583695 0.85 MMP8 (0.47) MMEGPR88
SCHEMBL13583683 0.85 MMP8 (0.47) MMEGPR88
SCHEMBL6138235 0.84 MME (0.56) MMEGPR88PTGS2
SCHEMBL27888056 0.84 LMNA (0.46) MMEACE2
SCHEMBL13583306 0.84 LMNA (0.46) MMEACE2
SCHEMBL27871926 0.84 KEAP1 (0.47) MMEPRSS1TMPRSS15ACE2
SCHEMBL13583345 0.84 KEAP1 (0.47) MMEPRSS1TMPRSS15ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2356979-B1 ANTI-WRINKLE AGENTS POLA CHEM IND INC (JP) 2017-10-25 EP disclosed
EP-2524686-B1 PIGMENTATION-PREVENTING OR -AMELIORATING AGENT POLA CHEM IND INC (JP) 2017-06-21 EP disclosed
EP-3173063-A1 ANTI-WRINKLE AGENTS Pola Chemical Industries Inc. (JP) 2017-05-31 EP disclosed
US-9066914-B2 Prophylactic or ameliorating agent for pigmentation POLA CHEMICAL INDUSTRIES INC. (JP) 2015-06-30 US disclosed
CN-102686213-B Pigmentation-preventing or -ameliorating agent POLA CHEM IND INC 2014-11-12 CN disclosed
US-8835498-B2 Anti-wrinkle agents POLA CHEMICAL INDUSTRIES INC. (JP) 2014-09-16 US disclosed
EP-2524686-A1 PIGMENTATION-PREVENTING OR -AMELIORATING AGENT Pola Chemical Industries Inc. (JP) 2012-11-21 EP disclosed
US-20120282203-A1 PROPHYLACTIC OR AMELIORATING AGENT FOR PIGMENTATION POLA CHEMICAL INDUSTRIES INC. (JP) 2012-11-08 US disclosed
CN-102686213-A Pigmentation-preventing or -ameliorating agent POLA CHEM IND INC 2012-09-19 CN disclosed
US-20110245343-A1 ANTI-WRINKLE AGENTS POLA CHEMICAL INDUSTRIES INC. (JP) 2011-10-06 US disclosed
EP-2356979-A1 ANTI-WRINKLE AGENTS Pola Chemical Industries Inc. (JP) 2011-08-17 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 (2 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-20120282203-A1 PROPHYLACTIC OR AMELIORATING AGENT FOR PIGMENTATION TYR, MC1R, NQO1 MME 3695/4885GPR88 1511/4885ACE 4638/4885
US-20110245343-A1 ANTI-WRINKLE AGENTS GLA, H1-4, H1-3 MME 4624/4885GPR88 2362/4885ACE 4738/4885

“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.