SCHEMBL5365846

SCHEMBL5365846

C[C@@](O)(CSc1ccc(F)cc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1

nearest known ligand 0.85

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.79
CYP2C19 P33261 1/20 0.68
ABCB11 O95342 1/20 0.68
ALB P02768 1/20 0.68
PGR P06401 1/20 0.68
ADRA2C P18825 1/20 0.68
GHSR Q92847 1/20 0.68

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
SCHEMBL10062801 1.00 AR (0.79) ARCYP2C19ABCB11ALBPGR
SCHEMBL899788 1.00 AR (0.79) ARCYP2C19ABCB11ALBPGR
SCHEMBL30859064 1.00 AR (0.79) ARCYP2C19ABCB11ALBPGR
SCHEMBL15320418 0.92 AR (0.68) ARCYP2C19
SCHEMBL23113143 0.92 AR (0.79) AR
SCHEMBL23113144 0.92 AR (0.79) AR
SCHEMBL20843751 0.91 AR (0.78) AR
SCHEMBL20843745 0.91 AR (0.78) AR
SCHEMBL23113196 0.91 AR (0.78) AR
SCHEMBL22198011 0.91 AR (0.78) AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11571407-B2 Bicalutamide analogs or (S)-bicalutamide as exocytosis activating compounds for use in the treatment of a lysosomal storage disorder or glycogenosis BCN PEPTIDES, S.A. (ES) 2023-02-07 US disclosed
EP-3086784-B9 BICALUTAMIDE ANALOGS OR (S)-BICALUTAMIDE AS EXOCYTOSIS ACTIVATING COMPOUNDS FOR USE IN THE TREATMENT OF A LYSOSOMAL STORAGE DISORDER OR GLYCOGENOSIS BCN PEPTIDES SA (ES) 2019-10-16 EP disclosed
EP-3086784-B1 BICALUTAMIDE ANALOGS OR (S)-BICALUTAMIDE AS EXOCYTOSIS ACTIVATING COMPOUNDS FOR USE IN THE TREATMENT OF A LYSOSOMAL STORAGE DISORDER OR GLYCOGENOSIS BCN PEPTIDES SA (ES) 2019-03-27 EP disclosed
US-20160317489-A1 Bicalutamide Analogs Or (S)-Bicalutamide As Exocytosis Activating Compounds For Use In The Treatment Of A Lysosomal Storage Disorder Or Glycogenosis BCN PEPTIDES, S.A. (ES) 2016-11-03 US disclosed
US-20160317489-A1 Bicalutamide Analogs Or (S)-Bicalutamide As Exocytosis Activating Compounds For Use In The Treatment Of A Lysosomal Storage Disorder Or Glycogenosis BCN PEPTIDES, S.A. (ES) 2016-11-03 US disclosed
WO-2015097088-A1 BICALUTAMIDE ANALOGS OR (S)-BI CALUTAM IDE AS EXOCYTOSIS ACTIVATING COMPOUNDS FOR USE IN THE TREATMENT OF A LYSOSOMAL STORAGE DISORDER OR GLYCOGENOSIS BCN PEPTIDES, S.A. (ES) 2015-07-02 WO disclosed
US-7199257-B1 Process for the synthesis of N-(4-cyano-3-trifluoromethylphenyl)-3-(4-fluorophenylsulfonyl)-2-hydroxy-2-methylpropionamide RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2007-04-03 US disclosed
EP-1189898-B1 PROCESS FOR THE SYNTHESIS OF N-(4-CYANO-3-TRIFLUOROMETHYLPHENYL)-3-(4-FLUOROPHENYLSULPHONYL)-2-HYDROXY-2-METHYLPROPIONAMIDE RICHTER GEDEON VEGYESZET (HU) 2003-03-12 EP disclosed
EP-1189898-A1 PROCESS FOR THE SYNTHESIS OF N-(4-CYANO-3-TRIFLUOROMETHYLPHENYL)-3-(4-FLUOROPHENYLSULPHONYL)-2-HYDROXY-2-METHYLPROPIONAMIDE RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 2002-03-27 EP disclosed
WO-2001000608-A1 PROCESS FOR THE SYNTHESIS OF N-(4-CYANO-3-TRIFLUOROMETHYLPHENYL)-3-(4-FLUOROPHENYLSULFONYL)-2-HYDROXY-2-METHYLPROPIONAMIDE Richter Gedeon Vegyészeti Gyár Rt. (HU) 2001-01-04 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 (2 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-11571407-B2 Bicalutamide analogs or (S)-bicalutamide as exocytosis activating compounds for use in the treatment of a lysosomal storage disorder or glycogenosis GBA1, GAA, GBA3 AR 669/4885CYP2C19 4643/4885ABCB11 1563/4885
US-20160317489-A1 Bicalutamide Analogs Or (S)-Bicalutamide As Exocytosis Activating Compounds For Use In The Treatment Of A Lysosomal Storage Disorder Or Glycogenosis GBA1, GAA, GBA3 AR 643/4885CYP2C19 4658/4885ABCB11 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.