SCHEMBL17021314

SCHEMBL17021314

CCC(=O)N1CCN(c2ccc(Nc3cc(NCc4cc(F)ccc4F)c(C(N)=O)nn3)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ STAT6 P42226 6/20 0.49
▸ SYK P43405 4/20 0.43
▸ JAK3 P52333 3/20 0.42
▸ IRAK4 Q9NWZ3 1/20 0.42
▸ MAPK1 P28482 1/20 0.40
▸ JAK2 O60674 2/20 0.39
▸ JAK1 P23458 2/20 0.39
▸ TYK2 P29597 1/20 0.39
▸ MAPT P10636 5/20 0.39
▸ GAA P10253 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ EGFR P00533 1/20 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
SCHEMBL19010267 0.93 STAT6 (0.45) STAT6SYKJAK3IRAK4MAPK1
SCHEMBL17021296 0.91 STAT6 (0.47) STAT6SYKJAK3MAPK1JAK2
SCHEMBL17021291 0.88 STAT6 (0.49) STAT6SYKJAK3MAPK1JAK2
SCHEMBL17021316 0.88 STAT6 (0.47) STAT6SYKJAK3MAPK1MAPT
SCHEMBL17021269 0.88 STAT6 (0.63) STAT6JAK3IRAK4JAK2JAK1
SCHEMBL17021303 0.87 STAT6 (0.49) STAT6SYKJAK3MAPK1JAK2
SCHEMBL17021325 0.87 STAT6 (0.47) STAT6SYKJAK3MAPK1JAK2
SCHEMBL19010277 0.84 KMT2A (0.44) STAT6SYKMAPK1MAPTGAA
SCHEMBL17009130 0.83 STAT6 (0.49) STAT6SYKJAK3MAPK1JAK2
SCHEMBL19010278 0.81 STAT6 (0.57) STAT6JAK3MAPK1JAK2JAK1

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 STAT6 8/4885SYK 248/4885JAK3 3/4885

“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.

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