SCHEMBL1765082

SCHEMBL1765082

O=C(O)c1cc(-c2cccc(OCCO)c2)n(-c2cccc(Cl)c2)n1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPP1CA P62136 2/20 0.64
L3MBTL1 Q9Y468 1/20 0.54
MARS1 P56192 2/20 0.53
RPA1 P27694 7/20 0.53
MDM2 Q00987 2/20 0.51
BCL2 P10415 1/20 0.51
MCL1 Q07820 1/20 0.51
SLC16A3 O15427 1/20 0.51
SLC16A1 P53985 1/20 0.51
MCTS1 Q9ULC4 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
NSD2 O96028 1/20 0.50
NSD1 Q96L73 1/20 0.50
NSD3 Q9BZ95 1/20 0.50
LPAR5 Q9H1C0 1/20 0.50
HPSE Q9Y251 1/20 0.50
FAAH O00519 1/20 0.49
FABP3 P05413 1/20 0.48
FABP4 P15090 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
SCHEMBL1764874 0.96 PPP1CA (0.61) PPP1CAL3MBTL1MARS1RPA1MDM2
SCHEMBL1765079 0.91 PPP1CA (0.60) PPP1CAL3MBTL1MARS1RPA1MDM2
SCHEMBL1765293 0.87 MDM2 (0.68) PPP1CAL3MBTL1MARS1RPA1MDM2
SCHEMBL1764923 0.87 FAAH (0.56) PPP1CASLC16A3SLC16A1MCTS1FAAH
SCHEMBL1764960 0.86 HRH3 (0.56) PPP1CANSD2NSD1NSD3LPAR5
SCHEMBL1765024 0.85 PPP1CA (0.68) PPP1CAL3MBTL1MARS1RPA1SLC16A3
SCHEMBL3431206 0.85 SLC16A3 (0.49) PPP1CASLC16A3SLC16A1MCTS1FAAH
SCHEMBL1765063 0.85 PPP1CA (0.82) PPP1CAL3MBTL1MARS1RPA1SMN1; SMN2
SCHEMBL1110689 0.83 PPP1CA (0.64) PPP1CAL3MBTL1MARS1RPA1SLC16A3
SCHEMBL1110855 0.82 PPP1CA (0.87) PPP1CAL3MBTL1MARS1RPA1SMN1; SMN2

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
US-8399682-B2 Substituted (pyrazolylcarbonyl)imidazolidinones and their use AICURIS GMBH & CO. KG (DE) 2013-03-19 US disclosed
US-8399682-B2 Substituted (pyrazolylcarbonyl)imidazolidinones and their use AICURIS GMBH & CO. KG (DE) 2013-03-19 US disclosed
US-8399682-B2 Substituted (pyrazolylcarbonyl)imidazolidinones and their use AICURIS GMBH & CO. KG (DE) 2013-03-19 US disclosed
US-20110124618-A1 SUBSTITUTED (PYRAZOLYLCARBONYL)IMIDAZOLIDINONES AND THEIR USE AICURIS GMBH & CO. KG (DE) 2011-05-26 US disclosed
US-20110124618-A1 SUBSTITUTED (PYRAZOLYLCARBONYL)IMIDAZOLIDINONES AND THEIR USE AICURIS GMBH & CO. KG (DE) 2011-05-26 US disclosed
US-20110124618-A1 SUBSTITUTED (PYRAZOLYLCARBONYL)IMIDAZOLIDINONES AND THEIR USE AICURIS GMBH & CO. KG (DE) 2011-05-26 US disclosed
EP-2254885-A1 (PYRAZOLYL CARBONYL)IMIDAZOLIDINONE DERIVATIVES FOR THE TREATMENT OF RETROVIRAL DISEASES AiCuris GmbH & Co. KG (DE) 2010-12-01 EP disclosed
WO-2009115213-A1 (PYRAZOLYL CARBONYL)IMIDAZOLIDINONE DERIVATIVES FOR THE TREATMENT OF RETROVIRAL DISEASES AICURIS GMBH & CO. KG (DE) 2009-09-24 WO disclosed
WO-2009115213-A1 (PYRAZOLYL CARBONYL)IMIDAZOLIDINONE DERIVATIVES FOR THE TREATMENT OF RETROVIRAL DISEASES AICURIS GMBH & CO. KG (DE) 2009-09-24 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-20110124618-A1 SUBSTITUTED (PYRAZOLYLCARBONYL)IMIDAZOLIDINONES AND THEIR USE TPMT, PAICS, THPO PPP1CA 1664/4885L3MBTL1 1446/4885MARS1 1601/4885

“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.