SCHEMBL1764882

SCHEMBL1764882

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

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 2/20 0.50
▸ CA9 Q16790 3/20 0.45
▸ TP53 P04637 1/20 0.41
▸ FAAH O00519 6/20 0.41
▸ MGLL Q99685 2/20 0.40
▸ KDM1A O60341 2/20 0.39
▸ RPA1 P27694 1/20 0.39
▸ PGR P06401 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
SCHEMBL1765056 0.91 CHRNA7 (0.50) CHRNA7CA9TP53FAAHMGLL
SCHEMBL1765054 0.90 CHRNA7 (0.49) CHRNA7CA9TP53FAAHMGLL
SCHEMBL1765512 0.90 CA9 (0.50) CHRNA7CA9TP53FAAHMGLL
SCHEMBL1764971 0.87 TP53 (0.48) CHRNA7CA9TP53FAAHMGLL
SCHEMBL1765446 0.87 CHRNA7 (0.49) CHRNA7CA9TP53FAAHMGLL
SCHEMBL3434328 0.85 PGR (0.38) CHRNA7KDM1ARPA1PGR
SCHEMBL1765438 0.85 RPA1 (0.53) KDM1ARPA1
SCHEMBL1764902 0.85 CHRNA7 (0.50) CHRNA7CA9TP53FAAHMGLL
SCHEMBL5390665 0.81 TP53 (0.47) CHRNA7CA9TP53
SCHEMBL1765413 0.81 CHRNA7 (0.47) CHRNA7CA9TP53FAAHMGLL

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 7 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
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 CHRNA7 3365/4885CA9 4825/4885TP53 1099/4885

“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.

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