SCHEMBL981003

SCHEMBL981003

O=C(Cc1ccc2nsnc2c1)N1CCC(c2cc(Cl)ccc2O)=N1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.42
KDM4E B2RXH2 6/20 0.35
MAPT P10636 4/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 1/20 0.35
MCHR1 Q99705 1/20 0.34
ECE2 P0DPD6 1/20 0.34
MAOA P21397 5/20 0.34
MAOB P27338 5/20 0.34
ALDH1A1 P00352 4/20 0.33
THRB P10828 2/20 0.33
PPARG P37231 1/20 0.33
ERCC1 P07992 1/20 0.32
ERCC4 Q92889 1/20 0.32
ORAI1 Q96D31 1/20 0.32
GAA P10253 2/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL982372 0.91 MET (0.50) METKDM4EMAPTRAB9ASMN1; SMN2
SCHEMBL979197 0.87 ECE2 (0.49) METKDM4ERAB9AMEN1KMT2A
SCHEMBL979929 0.87 ECE2 (0.36) METKDM4EMAPTRAB9ASMN1; SMN2
SCHEMBL981648 0.87 MET (0.42) METKDM4ERAB9ASMN1; SMN2MEN1
SCHEMBL980254 0.85 PGR (0.46) METKDM4EMAPTRAB9ASMN1; SMN2
SCHEMBL979359 0.85 MET (0.49) METKMT2AMAOAMAOBERCC1
SCHEMBL982454 0.84 ME2 (0.44) METMAPTRAB9AMEN1KMT2A
SCHEMBL980992 0.83 MET (0.51) METMEN1KMT2AMAOAMAOB
SCHEMBL979452 0.83 PGR (0.41) METKDM4EMAPTRAB9ASMN1; SMN2
SCHEMBL980755 0.82 MET (0.41) METKDM4EMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1917248-B1 1-ACYLDIHYDROPYRAZOL DERIVATIVES MERCK PATENT GMBH (DE) 2015-08-19 EP claimed
US-7875644-B2 tyrosine kinase inhibitors, in particular Met kinase; antitumor agents;1-(Benzo-1,2,5-thiadiazol-5-ylmethylcarbonyl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole; leukemia, carcinomas MERCK PATENT GMBH (DE) 2011-01-25 US claimed
US-20080249095-A1 1-Acyldihydropyrazole Derivatives MERCK PATENT GESELLSCHAFT (DE) 2008-10-09 US claimed
EP-1917248-B1 1-ACYLDIHYDROPYRAZOL DERIVATIVES MERCK PATENT GMBH (DE) 2015-08-19 EP disclosed
US-7875644-B2 tyrosine kinase inhibitors, in particular Met kinase; antitumor agents;1-(Benzo-1,2,5-thiadiazol-5-ylmethylcarbonyl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole; leukemia, carcinomas MERCK PATENT GMBH (DE) 2011-01-25 US disclosed
US-7875644-B2 tyrosine kinase inhibitors, in particular Met kinase; antitumor agents;1-(Benzo-1,2,5-thiadiazol-5-ylmethylcarbonyl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole; leukemia, carcinomas MERCK PATENT GMBH (DE) 2011-01-25 US disclosed
US-20080249095-A1 1-Acyldihydropyrazole Derivatives MERCK PATENT GESELLSCHAFT (DE) 2008-10-09 US disclosed
US-20080249095-A1 1-Acyldihydropyrazole Derivatives MERCK PATENT GESELLSCHAFT (DE) 2008-10-09 US disclosed
WO-2007019933-A1 1-ACYLDIHYDROPYRAZOL DERIVATIVES MERCK PATENT GMBH (DE) 2007-02-22 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-20080249095-A1 1-Acyldihydropyrazole Derivatives MET, FLT3, ERBB3 MET 1/4885KDM4E 1005/4885MAPT 4012/4885

“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.