SCHEMBL300191

SCHEMBL300191

O=C(O)C=Cc1n[nH]c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 5/20 0.48
KDR P35968 4/20 0.48
MAP2K4 P45985 3/20 0.48
AURKA O14965 2/20 0.48
FLT3 P36888 2/20 0.48
TTK P33981 2/20 0.48
MAPK10 P53779 2/20 0.48
HDAC6 Q9UBN7 2/20 0.48
MAPK6 Q16659 2/20 0.48
PDPK1 O15530 2/20 0.48
BMPR1B O00238 1/20 0.48
PLK4 O00444 1/20 0.48
STK25 O00506 1/20 0.48
CIT O14578 1/20 0.48
RIOK3 O14730 1/20 0.48
IKBKB O14920 1/20 0.48
GAK O14976 1/20 0.48
DCLK1 O15075 1/20 0.48
CHUK O15111 1/20 0.48
MUSK O15146 1/20 0.48

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
SCHEMBL2945140 1.00 CHEK1 (0.48) CHEK1KDRMAP2K4AURKAFLT3
SCHEMBL2570808 0.85 KDR (0.47) CHEK1KDRMAP2K4AURKAFLT3
SCHEMBL13924410 0.81 KDM4E (0.54) CHEK1KDRMAP2K4AURKAFLT3
SCHEMBL2132768 0.81 KDM4E (0.54) CHEK1KDRMAP2K4AURKAFLT3
SCHEMBL3131646 0.81 KDM4E (0.54) CHEK1KDRMAP2K4AURKAFLT3
SCHEMBL4197352 0.80 MMP1 (0.57) AURKAITKKDM4EALDH1A1MAPK1
SCHEMBL4197357 0.80 MMP1 (0.57) AURKAITKKDM4EALDH1A1MAPK1
SCHEMBL12311266 0.80 CHEK1 (0.40) CHEK1KDRTTKCDK4CCNA2
SCHEMBL22130476 0.79 LMNA (0.56) CHEK1KDRAURKAFLT3CDK4
SCHEMBL10324487 0.79 CHEK1 (0.44) CHEK1KDRMAP2K4AURKAFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3632899-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RaQualia Pharma Inc. (JP) 2020-04-08 EP disclosed
EP-2435407-B1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC (JP) 2019-12-25 EP disclosed
US-9522140-B2 Aryl substituted carboxamide derivatives as calcium or sodium channel blockers RAQUALIA PHARMA INC. (JP) 2016-12-20 US disclosed
US-20150322052-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC (JP) 2015-11-12 US disclosed
US-9101616-B2 Aryl substituted carboxamide derivatives as calcium or sodium channel blockers RAQUALIA PHARMA INC. (JP) 2015-08-11 US disclosed
JP-2013216579-A METHOD FOR PRODUCING TRISUBSTITUTED INDAZOLEACRYLAMIDE DERIVATIVE MITSUBISHI TANABE PHARMA CORP 2013-10-24 JP disclosed
WO-2012005312-A1 PROCESS FOR PREPARATION OF TRISUBSTITUTED INDAZOLEACRYLAMIDE DERIVATIVES 田辺三菱製薬株式会社 (JP) 2012-01-12 WO disclosed
US-8022059-B2 Indazole acrylic acid amide compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-09-20 US disclosed
US-8022059-B2 Indazole acrylic acid amide compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-09-20 US disclosed
WO-2010137351-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC. (JP) 2010-12-02 WO disclosed
US-20100256108-A1 INDAZOLE ACRYLIC ACID AMIDE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-10-07 US disclosed
US-20100256108-A1 INDAZOLE ACRYLIC ACID AMIDE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-10-07 US disclosed
EP-2192116-A1 INDAZOLE ACRYLIC ACID AMIDE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2010-06-02 EP disclosed
EP-1648448-A4 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2009-04-01 EP disclosed
US-20080058515-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION 2008-03-06 US disclosed
US-20080058515-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION 2008-03-06 US disclosed
US-20080058515-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION 2008-03-06 US disclosed
EP-1648448-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-04-26 EP disclosed
WO-2005011681-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2005-02-10 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 (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-20150322052-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS CACNA1I, CACNA1G, CACNA1H CHEK1 4568/4885KDR 3745/4885MAP2K4 4236/4885
US-20080058515-A1 Chemical Compounds SGK1, SGK2, SGK3 CHEK1 113/4885KDR 4133/4885MAP2K4 559/4885
US-20100256108-A1 INDAZOLE ACRYLIC ACID AMIDE COMPOUND KCNH2, KCNH3, KCNJ11 CHEK1 2605/4885KDR 2531/4885MAP2K4 3061/4885

“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.