SCHEMBL20595083

SCHEMBL20595083

Cc1cc2c(ccn2-c2ccc(S(C)(=O)=O)cc2)cc1C#N

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.50
PTGS2 P35354 10/20 0.43
PTGS1 P23219 3/20 0.38

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
SCHEMBL28711440 0.79 CDC7 (0.45) PTGS2
SCHEMBL20025721 0.79 L3MBTL1 (0.44) KDM1A
SCHEMBL20657182 0.79 KDM1A (0.53) KDM1A
SCHEMBL20595214 0.77 KDM1A (0.60) KDM1APTGS2
SCHEMBL20595044 0.76 KDM1A (0.51) KDM1A
SCHEMBL20595090 0.70 KDM1A (0.53) KDM1APTGS2
SCHEMBL20595084 0.70 HTR6 (0.52)
SCHEMBL12595919 0.69 EPAS1 (0.46) KDM1APTGS2PTGS1
SCHEMBL13211334 0.69 EPAS1 (0.46) KDM1APTGS2PTGS1
SCHEMBL28317016 0.68 MAOA (0.35) KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114213396-B Indole-2-ketone compound and preparation method and application thereof 深圳市乐土生物医药有限公司 2023-03-24 CN disclosed
CN-114213396-A Indole-2-ketone compound and preparation method and application thereof 深圳市乐土生物医药有限公司 2022-03-22 CN disclosed
EP-3642195-A1 SUBSTITUTED 5-CYANOINDOLE COMPOUNDS AND USES THEREOF Novartis AG (CH) 2020-04-29 EP disclosed
CN-111032641-A Substituted 5-cyanoindole compounds and uses thereof 诺华股份有限公司 2020-04-17 CN disclosed
US-10604502-B2 Substituted 5-cyanoindole compounds and uses thereof NOVARTIS AG (CH) 2020-03-31 US disclosed
US-10604502-B2 Substituted 5-cyanoindole compounds and uses thereof NOVARTIS AG (CH) 2020-03-31 US disclosed
US-20190023684-A1 SUBSTITUTED 5-CYANOINDOLE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2019-01-24 US disclosed
US-20190023684-A1 SUBSTITUTED 5-CYANOINDOLE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2019-01-24 US disclosed
WO-2018234978-A1 SUBSTITUTED 5-CYANOINDOLE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2018-12-27 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 (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-10604502-B2 Substituted 5-cyanoindole compounds and uses thereof KDM1A, KDM5A, KDM1B KDM1A 1/4885PTGS2 3465/4885PTGS1 2734/4885
US-20190023684-A1 SUBSTITUTED 5-CYANOINDOLE COMPOUNDS AND USES THEREOF KDM1A, KDM5A, KDM1B KDM1A 1/4885PTGS2 3465/4885PTGS1 2734/4885

“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.