SCHEMBL1764877

SCHEMBL1764877

N#Cc1cc(F)cc(-c2cc(C(=O)O)nn2-c2cccc(C#N)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RPA1 P27694 8/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
PPP1CA P62136 3/20 0.50
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MDM2 Q00987 2/20 0.44
BCL2 P10415 1/20 0.44
MCL1 Q07820 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL1765538 0.91 PPP1CA (0.63) RPA1MEN1KMT2APPP1CAATM
SCHEMBL1765405 0.90 PPP1CA (0.56) RPA1MEN1KMT2APPP1CAATM
SCHEMBL1765005 0.90 RPA1 (0.63) RPA1MEN1KMT2APPP1CAL3MBTL1
SCHEMBL16921436 0.85 KMT2A (0.73) RPA1MEN1KMT2APPP1CAATM
SCHEMBL1765438 0.85 RPA1 (0.53) RPA1MEN1KMT2APPP1CAATM
SCHEMBL1765446 0.85 CHRNA7 (0.49) KMT2AMDM2BCL2MCL1
SCHEMBL1765497 0.84 RPA1 (0.64) RPA1MEN1KMT2APPP1CAATM
SCHEMBL1110646 0.83 PPP1CA (0.70) RPA1MEN1KMT2APPP1CAATM
SCHEMBL1765061 0.83 RPA1 (0.62) RPA1MEN1KMT2APPP1CAATM
SCHEMBL1765021 0.82 PPP1CA (0.68) RPA1MEN1KMT2APPP1CAATM

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 8 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

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 3978/4885MEN1 2360/4885KMT2A 1193/4885

“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.