SCHEMBL1765059

SCHEMBL1765059

O=C(O)c1cc(-c2cccc(OC(F)(F)F)c2)n(-c2ccc(F)c(Cl)c2)n1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MARS1 P56192 2/20 0.59
RPA1 P27694 12/20 0.57
PPP1CA P62136 3/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ATM Q13315 1/20 0.50
SMN1; SMN2 Q16637 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
SCHEMBL1110689 0.90 PPP1CA (0.64) MARS1RPA1PPP1CASMN1; SMN2
SCHEMBL16921447 0.89 RPA1 (0.58) MARS1RPA1PPP1CAMEN1KMT2A
SCHEMBL16910537 0.89 MARS1 (0.60) MARS1RPA1PPP1CAMEN1KMT2A
SCHEMBL12597093 0.88 MARS1 (0.59) MARS1RPA1PPP1CAMEN1KMT2A
SCHEMBL1764873 0.88 RPA1 (0.64) MARS1RPA1PPP1CAMEN1KMT2A
SCHEMBL1764962 0.88 FAAH (0.55) MARS1RPA1
SCHEMBL15004289 0.87 MARS1 (0.58) MARS1RPA1PPP1CAMEN1KMT2A
SCHEMBL16910546 0.86 MARS1 (0.57) MARS1RPA1PPP1CAMEN1KMT2A
SCHEMBL16921424 0.86 RPA1 (0.59) MARS1RPA1PPP1CAMEN1KMT2A
SCHEMBL3425400 0.86 SLC5A1 (0.46) MARS1RPA1

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 6 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
CN-101977908-A (pyrazolyl carbonyl) imidazolidinone derivatives for the treatment of retroviral diseases AICURIS GMBH & CO KG 2011-02-16 CN 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 MARS1 1601/4885RPA1 3978/4885PPP1CA 1664/4885

“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.