SCHEMBL981808

SCHEMBL981808

COc1ccc(C2=NN(C(=O)CN3C=Cc4sncc4C3)CC2)c(OC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
MAOB P27338 3/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
ABCB1 P08183 1/20 0.34
NPC1 O15118 1/20 0.33
SCN9A Q15858 1/20 0.33
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
CA1 P00915 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33

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
SCHEMBL981647 0.86 MAOB (0.37) RAB9ASMN1; SMN2ALDH1A1HPGDMAOB
SCHEMBL980473 0.85 MAOB (0.53) RAB9ASMN1; SMN2ALDH1A1HPGDMAOB
SCHEMBL981837 0.83 MAOB (0.44) RAB9ASMN1; SMN2ALDH1A1HPGDMAOB
SCHEMBL984418 0.79 L3MBTL1 (0.41) RAB9ASMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL979415 0.77 MAOB (0.40) RAB9ASMN1; SMN2ALDH1A1HPGDMAOB
SCHEMBL17004386 0.76 HCRTR1 (0.35) RAB9ASMN1; SMN2ALDH1A1HPGDMAOB
SCHEMBL982251 0.75 ALDH1A1 (0.40) RAB9ASMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL981036 0.74 ALDH1A1 (0.30) RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL980163 0.74 JAK2 (0.36) RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL981541 0.72 PDE4B (0.38) ALDH1A1HPGDMAOBPDE4B

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 5 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
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

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 RAB9A 2347/4885SMN1; SMN2 4245/4885ALDH1A1 399/4885

“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.