SCHEMBL1765054

SCHEMBL1765054

CCOC(=O)c1cc(-c2cc(F)cc(C#N)c2)n(-c2ccc(F)c(Cl)c2)n1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.49
RPA1 P27694 4/20 0.47
CA9 Q16790 3/20 0.44
FAAH O00519 3/20 0.44
MGLL Q99685 2/20 0.43
RXFP1 Q9HBX9 1/20 0.42
TP53 P04637 1/20 0.41
PPP1CA P62136 1/20 0.40
GABRA2 P47869 1/20 0.39
GABRB2 P47870 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL1765280 0.90 CHRNA7 (0.50) CHRNA7RPA1CA9FAAHMGLL
SCHEMBL1764971 0.90 TP53 (0.48) CHRNA7CA9FAAHMGLLTP53
SCHEMBL1764882 0.90 CHRNA7 (0.50) CHRNA7RPA1CA9FAAHMGLL
SCHEMBL1526084 0.89 CHRNA7 (0.54) CHRNA7RPA1CA9FAAHMGLL
SCHEMBL1764884 0.88 CHRNA7 (0.53) CHRNA7RPA1CA9FAAHMGLL
SCHEMBL1765031 0.86 CHRNA7 (0.60) CHRNA7RPA1CA9FAAHMGLL
SCHEMBL1765446 0.86 CHRNA7 (0.49) CHRNA7CA9FAAHMGLLTP53
SCHEMBL1765484 0.86 CHRNA7 (0.52) CHRNA7RPA1CA9FAAHMGLL
SCHEMBL1764980 0.86 CHRNA7 (0.53) CHRNA7RPA1CA9FAAHMGLL
SCHEMBL3434352 0.86 RPA1 (0.39) CHRNA7RPA1RXFP1MEN1KMT2A

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
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

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 CHRNA7 3365/4885RPA1 3978/4885CA9 4825/4885

“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.