SCHEMBL1706769

SCHEMBL1706769

N#Cc1cc(Cl)c(C(=O)Nc2ccnc(Br)c2)c(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 15/20 0.65
JAK2 O60674 7/20 0.53
TAS1R3 Q7RTX0 1/20 0.49
TAS1R1 Q7RTX1 1/20 0.49
TAS1R2 Q8TE23 1/20 0.49
JAK1 P23458 2/20 0.46
PPARG P37231 3/20 0.46
GRM4 Q14833 1/20 0.45

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
SCHEMBL1706239 0.92 TYK2 (0.64) TYK2JAK2TAS1R3TAS1R1TAS1R2
SCHEMBL1706019 0.85 TYK2 (0.55) TYK2JAK2JAK1
SCHEMBL3517558 0.85 TYK2 (0.70) TYK2JAK2TAS1R3TAS1R1TAS1R2
SCHEMBL3515207 0.85 TYK2 (0.65) TYK2JAK2TAS1R3TAS1R1TAS1R2
SCHEMBL1706164 0.83 TYK2 (0.52) TYK2JAK2JAK1
SCHEMBL21056025 0.82 PPARG (0.66) TYK2JAK2JAK1PPARGGRM4
SCHEMBL1707688 0.82 TYK2 (0.70) TYK2JAK2JAK1
SCHEMBL1706538 0.82 TYK2 (0.63) TYK2JAK2TAS1R3TAS1R1TAS1R2
SCHEMBL1706693 0.80 TYK2 (0.49) TYK2JAK2JAK1
SCHEMBL1706158 0.79 TYK2 (1.00) TYK2JAK2JAK1

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
US-8486950-B2 Janus kinase inhibitor compounds and methods F. HOFFMANN-LA ROCHE AG (CH) 2013-07-16 US disclosed
EP-2440529-A1 JANUS KINASE INHIBITOR COMPOUNDS AND METHODS F. Hoffmann-La Roche AG (CH) 2012-04-18 EP disclosed
WO-2010142752-A1 JANUS KINASE INHIBITOR COMPOUNDS AND METHODS F. HOFFMANN-LA ROCHE AG (CH) 2010-12-16 WO disclosed
US-20100317643-A1 JANUS KINASE INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2010-12-16 US 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-20100317643-A1 JANUS KINASE INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 TYK2 21/4885JAK2 1/4885TAS1R3 1766/4885

“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.