SCHEMBL1764984

SCHEMBL1764984

COc1cccc(-n2nc(C(=O)O)cc2-c2cccc(F)c2)c1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RPA1 P27694 8/20 0.63
NSD2 O96028 1/20 0.60
NSD1 Q96L73 1/20 0.60
NSD3 Q9BZ95 1/20 0.60
LPAR5 Q9H1C0 1/20 0.60
HPSE Q9Y251 1/20 0.60
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
PPP1CA P62136 3/20 0.52
MDM2 Q00987 3/20 0.51
MCL1 Q07820 3/20 0.51
BCL2 P10415 2/20 0.51
SLC16A3 O15427 2/20 0.49
SLC16A1 P53985 2/20 0.49
MCTS1 Q9ULC4 2/20 0.49
FAAH O00519 1/20 0.49

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
SCHEMBL1765024 0.86 PPP1CA (0.68) RPA1NSD2NSD1NSD3LPAR5
SCHEMBL1765356 0.86 FAAH (0.56) RPA1FAAH
SCHEMBL1110892 0.85 RPA1 (0.60) RPA1NSD2NSD1NSD3LPAR5
SCHEMBL3428061 0.84 SLC16A3 (0.48) RPA1NSD2NSD1NSD3LPAR5
SCHEMBL1764873 0.84 RPA1 (0.64) RPA1NSD2NSD1NSD3LPAR5
SCHEMBL1764890 0.83 KMT2A (0.82) RPA1MEN1KMT2APPP1CA
SCHEMBL2910507 0.82 KMT2A (0.56) RPA1MEN1KMT2APPP1CAMDM2
SCHEMBL1765022 0.82 PPP1CA (0.63) RPA1NSD2NSD1NSD3LPAR5
SCHEMBL16921442 0.81 NSD2 (0.62) RPA1NSD2NSD1NSD3LPAR5
SCHEMBL27824578 0.81 MARS1 (0.60) RPA1MEN1KMT2APPP1CASLC16A3

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 RPA1 3978/4885NSD2 1679/4885NSD1 890/4885

“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.