SCHEMBL1809535

SCHEMBL1809535

Cc1cc(N)ccc1N1CCS(O)(O)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.65
MAPT P10636 8/20 0.65
MEN1 O00255 5/20 0.65
KMT2A Q03164 5/20 0.65
GAA P10253 4/20 0.65
THRB P10828 3/20 0.65
NR4A1 P22736 1/20 0.65
PTK2B Q14289 1/20 0.65
GFER P55789 3/20 0.56
RAD52 P43351 2/20 0.56
KDM4E B2RXH2 3/20 0.47
ALOX15 P16050 2/20 0.47
LMNA P02545 2/20 0.47
POLB P06746 1/20 0.41
HTT P42858 3/20 0.41
YWHAG P61981 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PDE10A Q9Y233 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
MAPK1 P28482 2/20 0.39

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
SCHEMBL15709816 0.86 MAPT (0.52) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL15358737 0.84 MAPT (0.81) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL1809536 0.83 ALDH1A1 (0.65) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL29477783 0.81 ALDH1A1 (0.71) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL187881 0.81 ALDH1A1 (0.71) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL7031588 0.80 ALDH1A1 (0.89) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL6156455 0.80 ALDH1A1 (0.96) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL16824888 0.80 MAPT (0.41) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL2255149 0.80 MAPT (0.58) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL6272228 0.79 ALDH1A1 (0.86) ALDH1A1MAPTMEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2017278-B1 DIHYDROPYRAZOLOPYRIMIDINONE DERIVATIVE MSD KK (JP) 2016-11-02 EP disclosed
US-20140303178-A1 DIHYDROPYRAZOLOPYRIMIDINONE DERIVATIVES MSD KK (JP) 2014-10-09 US disclosed
US-8791125-B2 Dihydropyrazolopyrimidinone derivatives MSD K.K. (JP) 2014-07-29 US disclosed
EP-2213673-B1 PYRIDONE-SUBSTITUTED-DIHYDROPYRAZOLOPYRIMIDINONE DERIVATIVE MSD KK (JP) 2013-06-05 EP disclosed
US-8329711-B2 Pyridone-substituted-dihydropyrazolopyrimidinone derivative MSD K.K. (JP) 2012-12-11 US disclosed
US-20110189130-A1 DIHYDROPYRAZOLOPYRIMIDINONE DERIVATIVES SAGARA TAKESHI 2011-08-04 US disclosed
US-7935708-B2 Dihydropyrazolopyrimidinone derivatives MSD K.K. (JP) 2011-05-03 US disclosed
US-7834019-B2 Substituted pyrazolo[3,4-d]pyrimidinone derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-11-16 US disclosed
US-20100221211-A1 PYRIDONE-SUBSTITUTED-DIHYDROPYRAZOLOPYRIMIDINONE DERIVATIVE MSD K.K. (JP) 2010-09-02 US disclosed
EP-2213673-A1 PYRIDONE-SUBSTITUTED-DIHYDROPYRAZOLOPYRIMIDINONE DERIVATIVE Banyu Pharmaceutical Co., Ltd. (JP) 2010-08-04 EP disclosed
US-20100063024-A1 Dihydropyrazolopyrimidinone Derivatives MERCK SHARP & DOHME LLC 2010-03-11 US disclosed
EP-2017278-A1 DIHYDROPYRAZOLOPYRIMIDINONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-01-21 EP disclosed
US-20070254892-A1 Dihydropyrazolopyrimidinone derivatives MSD K.K. (JP) 2007-11-01 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 (5 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-20110189130-A1 DIHYDROPYRAZOLOPYRIMIDINONE DERIVATIVES WEE1, WEE2, GRK3 ALDH1A1 755/4885MAPT 4041/4885MEN1 2199/4885
US-20100221211-A1 PYRIDONE-SUBSTITUTED-DIHYDROPYRAZOLOPYRIMIDINONE DERIVATIVE WEE1, WEE2, CCNE1 ALDH1A1 2764/4885MAPT 4870/4885MEN1 528/4885
US-20100063024-A1 Dihydropyrazolopyrimidinone Derivatives WEE1, WEE2, GRK3 ALDH1A1 755/4885MAPT 4041/4885MEN1 2199/4885
US-20070254892-A1 Dihydropyrazolopyrimidinone derivatives WEE1, WEE2, GRK3 ALDH1A1 755/4885MAPT 4041/4885MEN1 2199/4885
US-20140303178-A1 DIHYDROPYRAZOLOPYRIMIDINONE DERIVATIVES WEE1, WEE2, GRK3 ALDH1A1 755/4885MAPT 4041/4885MEN1 2199/4885

“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.