SCHEMBL1142340

SCHEMBL1142340

CC(C)(N)c1ccc(-c2ccc3[nH]nc(C=NO)c3c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 14/20 0.44
▸ JAK3 P52333 3/20 0.39
▸ MAP2K4 P45985 3/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ MAPKAPK3 Q16644 2/20 0.38
▸ MAPK6 Q16659 2/20 0.38
▸ MAPKAPK2 P49137 1/20 0.38
▸ PDPK1 O15530 1/20 0.38
▸ PLK4 O00444 2/20 0.36
▸ DAPK3 O43293 2/20 0.36
▸ DYRK3 O43781 2/20 0.36
▸ ROCK2 O75116 2/20 0.36
▸ MAP4K4 O95819 2/20 0.36
▸ CDK1 P06493 2/20 0.36
▸ CDK2 P24941 2/20 0.36
▸ MARK3 P27448 2/20 0.36
▸ TYK2 P29597 2/20 0.36
▸ CLK2 P49760 2/20 0.36
▸ CDK5 Q00535 2/20 0.36
▸ PRKCD Q05655 2/20 0.36

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
SCHEMBL13011677 1.00 JAK2 (0.44) JAK2JAK3MAP2K4MAPK1MAPKAPK3
SCHEMBL1142337 1.00 JAK2 (0.44) JAK2JAK3MAP2K4MAPK1MAPKAPK3
Hydrochloric Acid SCHEMBL1141267 0.99 JAK2 (0.43) JAK2JAK3MAP2K4MAPK1MAPKAPK3
Hydrochloric Acid SCHEMBL1141269 0.99 JAK2 (0.43) JAK2JAK3MAP2K4MAPK1MAPKAPK3
SCHEMBL11913101 0.83 JAK2 (0.46) JAK2JAK3MAP2K4MAPK1MAPKAPK3
SCHEMBL11911421 0.83 JAK2 (0.43) JAK2JAK3MAP2K4MAPK1MAPKAPK3
SCHEMBL12009240 0.78 JAK2 (0.43) JAK2JAK3PDPK1DYRK3MAP4K4
SCHEMBL1142174 0.78 JAK2 (0.43) JAK2JAK3PDPK1DYRK3MAP4K4
SCHEMBL1142176 0.78 JAK2 (0.43) JAK2JAK3PDPK1DYRK3MAP4K4
SCHEMBL1142228 0.78 JAK2 (0.64) JAK2JAK3MAPK1PLK4DAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232308-B2 Methods for treating a disease in which Rho kinase is involved UBE INDUSTRIES, LTD. (JP) 2012-07-31 — — US claimed
EP-2468729-A1 Novel indazole derivative UBE INDUSTRIES, LTD. (JP) 2012-06-27 — — EP claimed
US-20110039891-A1 Methods for treating a disease in which Rho kinase is involved UBE INDUSTRIES, LTD. (JP) 2011-02-17 — — US claimed
US-7855222-B2 Methods for treating a disease in which Rho kinase is involved UBE INDUSTRIES, LTD. (JP) 2010-12-21 — — US claimed
US-20090264468-A1 Methods for treating a disease in which Rho kinase is involved UBE INDUSTRIES, LTD. (JP) 2009-10-22 — — US claimed
US-7563906-B2 Indazole derivatives UBE INDUSTRIES, LTD. (JP) 2009-07-21 — — US claimed
US-20070129404-A1 Novel indazole derivatives UBE INDUSTRIES, LTD. (JP) 2007-06-07 — — US claimed
EP-1679308-A1 NOVEL INDAZOLE DERIVATIVE Ube Industries, Ltd. (JP) 2006-07-12 — — EP claimed
US-8232308-B2 Methods for treating a disease in which Rho kinase is involved UBE INDUSTRIES, LTD. (JP) 2012-07-31 — — US disclosed
EP-2468729-A1 Novel indazole derivative UBE INDUSTRIES, LTD. (JP) 2012-06-27 — — EP disclosed
US-7855222-B2 Methods for treating a disease in which Rho kinase is involved UBE INDUSTRIES, LTD. (JP) 2010-12-21 — — US disclosed
US-20090264468-A1 Methods for treating a disease in which Rho kinase is involved UBE INDUSTRIES, LTD. (JP) 2009-10-22 — — US disclosed
US-7563906-B2 Indazole derivatives UBE INDUSTRIES, LTD. (JP) 2009-07-21 — — US disclosed
US-20070129404-A1 Novel indazole derivatives UBE INDUSTRIES, LTD. (JP) 2007-06-07 — — US disclosed
EP-1679308-A1 NOVEL INDAZOLE DERIVATIVE Ube Industries, Ltd. (JP) 2006-07-12 — — EP 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 (3 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-20090264468-A1 Methods for treating a disease in which Rho kinase is involved RHOA, ROCK1, RHOT2 JAK2 313/4885JAK3 750/4885MAP2K4 1120/4885
US-20070129404-A1 Novel indazole derivatives CIT, ROCK1, ROCK2 JAK2 629/4885JAK3 617/4885MAP2K4 881/4885
US-20110039891-A1 Methods for treating a disease in which Rho kinase is involved RHOA, ROCK1, ROCK2 JAK2 317/4885JAK3 684/4885MAP2K4 1157/4885

“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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