SCHEMBL6633803

SCHEMBL6633803

CSc1nccc(C(=O)N(C)N(C(=O)Cc2ccc(F)cc2)C2CCN(C(=O)OC(C)(C)C)CC2)n1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GPR119 Q8TDV5 15/20 0.42
ENPP2 Q13822 1/20 0.40
WNT3A P56704 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39

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
SCHEMBL6620240 0.94 MEN1 (0.43) MEN1KMT2AGPR119ENPP2WNT3A
SCHEMBL6636072 0.74 USP30 (0.44) GPR119
SCHEMBL6689374 0.72 GPR119 (0.42) GPR119
SCHEMBL23929008 0.70 GPR119 (0.48) GPR119WNT3A
SCHEMBL16855544 0.69 GPR119 (0.51) MEN1KMT2AGPR119
SCHEMBL25389253 0.69 GPR119 (0.59) MEN1KMT2AGPR119
SCHEMBL6634519 0.69 MEN1 (0.48) MEN1KMT2AGPR119
SCHEMBL14521993 0.69 GPR119 (0.47) KMT2AGPR119
SCHEMBL3486530 0.68 GPR119 (0.69) GPR119
SCHEMBL6881409 0.68 MAPK14 (0.62)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1485167-A1 1,2-DIHYDROPYRAZOL-3-ONES AS CYTOKINE MEDIATORS The Procter & Gamble Company (US) 2004-12-15 EP disclosed
US-6677337-B2 RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, INFLAMMATORY BOWEL DISEASE, CACHEXIA, SEPTIC SHOCK, CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS THE PROCTER & GAMBLE COMPANY 2004-01-13 US disclosed
US-20030225082-A1 1,2-dihydropyrazol-3-ones which controls inflammatory cytokines PROCTER & GAMBLE COMPANY, THE 2003-12-04 US disclosed
WO-2003080184-A1 1,2-DIHYDROPYRAZOL-3-ONES AS CYTOKINE MEDIATORS THE PROCTER & GAMBLE COMPANY (US) 2003-10-02 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-20030225082-A1 1,2-dihydropyrazol-3-ones which controls inflammatory cytokines IL1B, IL1A, IL1R1 MEN1 2523/4885KMT2A 4690/4885GPR119 1225/4885

“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.