SCHEMBL1623799

SCHEMBL1623799

Cc1cc(Nc2ccc(C#N)c(Cl)n2)n[nH]1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 4/20 0.45
JAK2 O60674 3/20 0.45
LIMK1 P53667 2/20 0.45
LIMK2 P53671 1/20 0.45
ITK Q08881 1/20 0.44
AURKA O14965 12/20 0.44
CYP2D6 P10635 3/20 0.42
CYP3A4 P08684 2/20 0.42
CYP1A2 P05177 1/20 0.42
LCK P06239 2/20 0.42
RET P07949 2/20 0.42
FLT3 P36888 2/20 0.42
MUSK O15146 1/20 0.42
NTRK1 P04629 1/20 0.42
FGFR3 P22607 1/20 0.42
CCNE1 P24864 1/20 0.42
CDK2 P24941 1/20 0.42
PTK2B Q14289 1/20 0.42
MEN1 O00255 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL1620653 0.83 IDH1 (0.37) JAK3JAK2LIMK1LIMK2AURKA
SCHEMBL2565184 0.80 JAK3 (0.57) JAK3JAK2LIMK1LIMK2AURKA
SCHEMBL1621822 0.80 PLK4 (0.49) JAK3JAK2LIMK1LIMK2AURKA
SCHEMBL1623917 0.79 IGF1R (0.50) JAK3JAK2CDK2PAK4IGF1R
SCHEMBL1623742 0.78 AURKA (0.61) AURKACYP2D6CYP3A4CYP1A2FYN
SCHEMBL1623148 0.77 JAK2 (0.61) JAK3JAK2LIMK1LIMK2AURKA
SCHEMBL3967909 0.77 AURKA (0.41) JAK3JAK2LIMK1LIMK2AURKA
SCHEMBL24667684 0.77 JAK2 (0.56) JAK3JAK2ITKAURKACYP2D6
SCHEMBL1620858 0.76 AURKA (0.51) AURKACYP2D6CYP3A4CYP1A2FYN
SCHEMBL12720660 0.75 ITK (0.44) JAK3JAK2LIMK1ITKAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1876178-B1 CYANOPYRIDINE DERIVATIVE AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORP (JP) 2015-05-27 EP claimed
US-20090292121-A1 Cyanopyridine derivative and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-26 US claimed
EP-1876178-A1 CYANOPYRIDINE DERIVATIVE AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2008-01-09 EP claimed
US-20220233513-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF TYK MEDICINES, INC. (CN) 2022-07-28 US disclosed
WO-2020233641-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF 浙江同源康医药股份有限公司 (CN) 2020-11-26 WO disclosed
EP-1876178-B1 CYANOPYRIDINE DERIVATIVE AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORP (JP) 2015-05-27 EP disclosed
US-7928126-B2 Cyanopyridine derivative and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-04-19 US disclosed
US-7928126-B2 Cyanopyridine derivative and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-04-19 US disclosed
US-20090292121-A1 Cyanopyridine derivative and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-26 US disclosed
US-20090292121-A1 Cyanopyridine derivative and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-26 US disclosed
EP-1876178-A1 CYANOPYRIDINE DERIVATIVE AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2008-01-09 EP disclosed
EP-1876178-A1 CYANOPYRIDINE DERIVATIVE AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2008-01-09 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 (2 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-20090292121-A1 Cyanopyridine derivative and use thereof as medicine DPYD, IDH1, TP53 JAK3 3827/4885JAK2 1180/4885LIMK1 1660/4885
US-20220233513-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF RET, ROR1, FGFR3 JAK3 265/4885JAK2 87/4885LIMK1 398/4885

“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.