SCHEMBL19010368

SCHEMBL19010368

CC(=O)c1nnc(Nc2ccc(N3CCC(C(=O)N(C)C)CC3)cc2)cc1NCc1cccc(F)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ STAT6 P42226 1/20 0.43
▸ F10 P00742 5/20 0.42
▸ NTRK1 P04629 4/20 0.41
▸ SYK P43405 2/20 0.40
▸ JAK3 P52333 3/20 0.40
▸ JAK2 O60674 3/20 0.39
▸ CCNT1 O60563 1/20 0.39
▸ F2 P00734 1/20 0.38
▸ ELANE P08246 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ GFER P55789 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
SCHEMBL17021376 0.93 STAT6 (0.48) STAT6F10NTRK1SYKJAK3
SCHEMBL17021343 0.88 STAT6 (0.44) STAT6F10NTRK1SYKJAK3
SCHEMBL19010329 0.87 SYK (0.42) STAT6F10SYKJAK3JAK2
SCHEMBL19010269 0.86 STAT6 (0.57) STAT6NTRK1JAK3JAK2CCNT1
SCHEMBL19010276 0.85 GFER (0.54) STAT6NTRK1SYKJAK3POLB
SCHEMBL19010325 0.85 STAT6 (0.46) STAT6NTRK1JAK3JAK2JAK1
SCHEMBL19010268 0.83 JAK3 (0.46) STAT6NTRK1JAK3JAK2POLB
SCHEMBL19010307 0.81 PTK2 (0.41) NTRK1JAK3TDP1
SCHEMBL17021340 0.80 SYK (0.47) STAT6F10SYKJAK3JAK2
SCHEMBL17021284 0.79 GFER (0.52) STAT6NTRK1SYKJAK3TDP1

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 2 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-20170174673-A1 PYRIDAZINE COMPOUNDS AS JAK INHIBITORS ALEXION PHARMACEUTICALS, INC. 2017-06-22 — — 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-20170174673-A1 PYRIDAZINE COMPOUNDS AS JAK INHIBITORS JAK1, JAK2, JAK3 STAT6 8/4885F10 2668/4885NTRK1 1410/4885

“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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