SCHEMBL1751822

SCHEMBL1751822

CCC(=O)c1cc(Cl)nnc1OC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.44
ALDH1A1 P00352 4/20 0.40
LMNA P02545 2/20 0.40
L3MBTL1 Q9Y468 4/20 0.39
RAB9A P51151 1/20 0.39
HSP90AB1 P08238 1/20 0.35
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
KDM4E B2RXH2 2/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL25228251 0.85 ALDH1A1 (0.39) ALDH1A1LMNAL3MBTL1RAB9APOLB
SCHEMBL17141437 0.81 POLB (0.43) ALDH1A1LMNAL3MBTL1RAB9APOLB
SCHEMBL1750237 0.81 ALDH1A1 (0.46) ALDH1A1LMNAL3MBTL1RAB9APOLB
SCHEMBL6826837 0.79 CASP1 (0.43) ALDH1A1LMNAL3MBTL1RAB9APOLB
SCHEMBL15633425 0.79 KDM4E (0.46) ALDH1A1LMNAL3MBTL1RAB9APOLB
SCHEMBL17773615 0.73 ALDH1A1 (0.34) ALDH1A1LMNAL3MBTL1RAB9ATDP1
SCHEMBL1749975 0.72 HMGCR (0.40) HMGCRALDH1A1L3MBTL1HSP90AB1POLB
SCHEMBL24493747 0.69 HMGCR (0.42) HMGCRL3MBTL1KMT2ASMN1; SMN2
SCHEMBL27978039 0.69 HMGCR (0.42) HMGCRALDH1A1L3MBTL1HSP90AB1POLB
SCHEMBL15633238 0.68 PDE4A (0.38) ALDH1A1LMNAL3MBTL1RAB9APOLB

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-1753743-B1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS SANOFI AVENTIS DEUTSCHLAND (DE) 2015-03-04 EP disclosed
US-7968546-B2 Pyridazinone kinase inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-06-28 US disclosed
US-7709466-B2 Pyridazinone derivatives, methods for their production and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-05-04 US disclosed
US-20090130209-A1 Novel Pyridazinone Derivatives AVENTIS PHARMA S.A. (FR) 2009-05-21 US disclosed
US-7507734-B2 Pyridazinone derivatives AVENTIS PHARMA S.A. (FR) 2009-03-24 US disclosed
US-20070259870-A1 Novel Pyridazinone Derivatives AVENTIS PHARMA S.A. (FR) 2007-11-08 US disclosed
US-20070088041-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-04-19 US disclosed
EP-1753743-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS Sanofi-Aventis Deutschland GmbH (DE) 2007-02-21 EP disclosed
EP-1751141-A1 NOVEL PYRIDAZINONE DERIVATIVES AS INHIBITORS OF CDK2 Aventis Pharma S.A. (FR) 2007-02-14 EP disclosed
EP-1604988-A1 Pyridazinone derivatives, methods for producing them and their use as pharmaceuticals Sanofi-Aventis Deutschland GmbH (DE) 2005-12-14 EP disclosed
WO-2005111018-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-11-24 WO disclosed
WO-2005111019-A1 NOVEL PYRIDAZINONE DERIVATIVES AS INHIBITORS OF CDK2 AVENTIS PHARMA S.A. (FR) 2005-11-24 WO disclosed
EP-1598348-A1 Novel pyridazinone derivatives as inhibitors of CDK2 Aventis Pharma Deutschland GmbH (DE) 2005-11-23 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 (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-20070088041-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICALS GSK3B, GSK3A, PDXK HMGCR 672/4885ALDH1A1 2673/4885LMNA 807/4885
US-20090130209-A1 Novel Pyridazinone Derivatives CDK2, CDK1, CDK20 HMGCR 4499/4885ALDH1A1 3043/4885LMNA 919/4885
US-20070259870-A1 Novel Pyridazinone Derivatives CDK2, CDK1, CDK20 HMGCR 4499/4885ALDH1A1 3043/4885LMNA 919/4885

“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.