SCHEMBL1198179

SCHEMBL1198179

CC(C)(C#N)Oc1ccc(Nc2nc(Nc3cccc(C(N)=O)c3)ncc2F)cc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 11/20 0.62
▸ AURKA O14965 3/20 0.58
▸ JAK2 O60674 2/20 0.58
▸ AURKB Q96GD4 1/20 0.58
▸ EGFR P00533 4/20 0.56
▸ ITK Q08881 2/20 0.56
▸ CCNT1 O60563 2/20 0.51
▸ CCNE1 P24864 2/20 0.51
▸ CDK2 P24941 2/20 0.51
▸ CDK9 P50750 2/20 0.51
▸ LYN P07948 1/20 0.51
▸ TEC P42680 1/20 0.51
▸ TXK P42681 1/20 0.51
▸ BMX P51813 1/20 0.51
▸ JAK3 P52333 1/20 0.51
▸ BTK Q06187 1/20 0.51
▸ CD69 Q07108 1/20 0.51

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
SCHEMBL1197367 0.91 AURKA (0.65) SYKAURKAJAK2AURKBEGFR
SCHEMBL1197903 0.85 SYK (0.75) SYKAURKAJAK2AURKBEGFR
SCHEMBL1198276 0.85 SYK (0.61) SYKAURKAJAK2AURKBEGFR
SCHEMBL4002854 0.84 SYK (0.60) SYKAURKAJAK2AURKBEGFR
SCHEMBL1197940 0.82 SYK (0.80) SYKAURKAJAK2AURKBEGFR
SCHEMBL1197542 0.82 EGFR (0.67) SYKAURKAJAK2AURKBEGFR
SCHEMBL1197653 0.81 AURKA (0.62) SYKAURKAJAK2AURKBEGFR
SCHEMBL4007312 0.81 SYK (0.58) SYKAURKAJAK2AURKBEGFR
SCHEMBL1198274 0.81 SYK (0.65) SYKAURKAJAK2AURKBEGFR
SCHEMBL4001524 0.80 SYK (0.67) SYKAURKAJAK2AURKBEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7834024-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2010-11-16 — — US claimed
US-20080260754-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. 2008-10-23 — — US claimed
WO-2008118823-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2008-10-02 — — WO claimed
US-8299087-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2012-10-30 — — US disclosed
US-20110027856-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2011-02-03 — — US disclosed
US-7834024-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2010-11-16 — — US disclosed
US-20080260754-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. 2008-10-23 — — US disclosed
WO-2008118823-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2008-10-02 — — 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-20080260754-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 SYK 62/4885AURKA 751/4885JAK2 2/4885

“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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