SCHEMBL17021366

SCHEMBL17021366

CS(=O)(=O)c1ccc(Nc2cc(NCc3cccc(F)c3)c(C(N)=O)nn2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 7/20 0.44
▸ JAK2 O60674 5/20 0.44
▸ JAK1 P23458 5/20 0.44
▸ TYK2 P29597 5/20 0.44
▸ CDC7 O00311 1/20 0.43
▸ ROCK2 O75116 1/20 0.43
▸ MAP4K4 O95819 1/20 0.43
▸ PIM1 P11309 1/20 0.43
▸ CDK2 P24941 1/20 0.43
▸ GSK3B P49841 1/20 0.43
▸ CLK4 Q9HAZ1 1/20 0.43
▸ NTRK1 P04629 2/20 0.43
▸ RPS6KB1 P23443 6/20 0.43
▸ PTK2 Q05397 1/20 0.42
▸ IRAK4 Q9NWZ3 2/20 0.41
▸ AURKA O14965 4/20 0.41
▸ AURKB Q96GD4 2/20 0.41
▸ PDPK1 O15530 1/20 0.41
▸ STAT6 P42226 1/20 0.40

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
SCHEMBL19010334 0.91 NTRK1 (0.42) JAK3CDC7ROCK2MAP4K4PIM1
SCHEMBL17021356 0.90 CDC7 (0.43) JAK3JAK2JAK1TYK2CDC7
SCHEMBL17021380 0.88 FFAR1 (0.44) JAK3JAK2JAK1TYK2CDC7
SCHEMBL17021339 0.88 CDC7 (0.41) JAK3JAK2JAK1TYK2CDC7
SCHEMBL17021355 0.87 JAK3 (0.41) JAK3JAK2JAK1TYK2CDC7
SCHEMBL17021363 0.87 PTK2 (0.45) JAK3CDC7ROCK2MAP4K4PIM1
SCHEMBL17021375 0.86 JAK3 (0.44) JAK3JAK2JAK1TYK2CDC7
SCHEMBL17021379 0.85 CDC7 (0.42) JAK3JAK2JAK1TYK2CDC7
SCHEMBL17021312 0.84 NTRK1 (0.47) JAK3JAK2JAK1TYK2CDC7
SCHEMBL17021367 0.83 RPS6KB1 (0.43) JAK3JAK2JAK1TYK2CDC7

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-9834548-B2 Pyridazine compounds as JAK inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2017-12-05 — — US disclosed
US-9834548-B2 Pyridazine compounds as JAK inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2017-12-05 — — US disclosed
US-20170174673-A1 PYRIDAZINE COMPOUNDS AS JAK INHIBITORS ALEXION PHARMACEUTICALS, INC. 2017-06-22 — — US disclosed
US-20170174673-A1 PYRIDAZINE COMPOUNDS AS JAK INHIBITORS ALEXION PHARMACEUTICALS, INC. 2017-06-22 — — US disclosed
WO-2015123453-A1 PYRIDAZINE COMPOUNDS AS JAK INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2015-08-20 — — 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-20170174673-A1 PYRIDAZINE COMPOUNDS AS JAK INHIBITORS JAK1, JAK2, JAK3 JAK3 3/4885JAK2 2/4885JAK1 1/4885

“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.

Send feedback