SCHEMBL5868883

SCHEMBL5868883

CC(C)(C)OC(=O)Nc1ccc(-c2cc(F)ccc2F)cc1N

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 4/20 0.45
CYP17A1 P05093 1/20 0.45
HDAC1 Q13547 6/20 0.43
CHRM3 P20309 6/20 0.42
CHRM2 P08172 2/20 0.42
CHRM1 P11229 2/20 0.42
KCNQ4 P56696 2/20 0.41
KCNQ5 Q9NR82 2/20 0.41
HDAC2 Q92769 4/20 0.41
ABCB1 P08183 1/20 0.40
ABCC1 P33527 1/20 0.40
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
HDAC3 O15379 1/20 0.40
NCOR2 Q9Y618 1/20 0.40

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
SCHEMBL5868867 0.90 AAK1 (0.45) AAK1CYP17A1HDAC1KCNQ4KCNQ5
SCHEMBL197036 0.87 CYP17A1 (0.54) AAK1CYP17A1HDAC1KCNQ4KCNQ5
SCHEMBL30059279 0.87 CYP17A1 (0.54) AAK1CYP17A1HDAC1KCNQ4KCNQ5
SCHEMBL29581478 0.87 HDAC1 (0.55) AAK1CYP17A1HDAC1KCNQ4KCNQ5
SCHEMBL197145 0.87 HDAC1 (0.55) AAK1CYP17A1HDAC1KCNQ4KCNQ5
SCHEMBL2316738 0.86 AAK1 (0.46) AAK1CYP17A1HDAC1ABCB1ABCC1
SCHEMBL25216132 0.85 CYP17A1 (0.54) AAK1CYP17A1HDAC1KCNQ4KCNQ5
SCHEMBL3766409 0.84 HDAC2 (0.51) AAK1CYP17A1HDAC1KCNQ4KCNQ5
SCHEMBL5868895 0.84 AAK1 (0.48) AAK1CYP17A1HDAC1KCNQ4KCNQ5
SCHEMBL30118376 0.84 AAK1 (0.48) AAK1CYP17A1HDAC1KCNQ4KCNQ5

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12365681-B2 Dihydrobenzimidazolones for medical treatment C4 THERAPEUTICS, INC. (US) 2025-07-22 US disclosed
CN-118206529-A Dihydrobenzimidazolone C4医药公司 2024-06-18 CN disclosed
US-20240109889-A1 DIHYDROBENZIMIDAZOLONES FOR MEDICAL TREATMENT C4 THERAPEUTICS, INC. (US) 2024-04-04 US disclosed
US-7151098-B2 Glutamate receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2006-12-19 US disclosed
US-20060148791-A1 Glutamate receptor antagonists ADAM GEO 2006-07-06 US disclosed
US-7018998-B2 Glutamate receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2006-03-28 US disclosed
US-6960578-B2 Glutamate receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2005-11-01 US disclosed
US-20050234048-A1 Glutamate receptor antagonists ADAM GEO 2005-10-20 US disclosed
EP-1224175-B1 BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2004-03-17 EP disclosed
US-20030092677-A1 Glutamate receptor antagonists ADAM GEO (DE) 2003-05-15 US disclosed
US-6509328-B1 Metabotropic glutamate receptor antagonists and accordingly are useful for the treatment of a range of neurological disorders, including psychosis, schizophrenia, Alzheimer's and others HOFFMANN-LA ROCHE INC. 2003-01-21 US disclosed
EP-1224175-A2 BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2002-07-24 EP disclosed
WO-2001029012-A2 BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2001-04-26 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 (5 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-20030092677-A1 Glutamate receptor antagonists GRM1, GRM3, GRM2 AAK1 1593/4885CYP17A1 1449/4885HDAC1 1283/4885
US-12365681-B2 Dihydrobenzimidazolones for medical treatment CRBN, CUL4A, ADRM1 AAK1 2222/4885CYP17A1 2308/4885HDAC1 824/4885
US-20050234048-A1 Glutamate receptor antagonists GRM3, GRM1, GRM2 AAK1 2207/4885CYP17A1 1907/4885HDAC1 1506/4885
US-20060148791-A1 Glutamate receptor antagonists GRM3, GRM1, GRM2 AAK1 2207/4885CYP17A1 1907/4885HDAC1 1506/4885
US-20240109889-A1 DIHYDROBENZIMIDAZOLONES FOR MEDICAL TREATMENT CRBN, CUL4A, ADRM1 AAK1 2222/4885CYP17A1 2308/4885HDAC1 824/4885

“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.