SCHEMBL2216153

SCHEMBL2216153

CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=O)N1Cc1ccc(S(F)(F)(F)(F)F)cc1

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.64
PGR P06401 1/20 0.64
HDAC3 O15379 1/20 0.56
HDAC4 P56524 1/20 0.56
HDAC1 Q13547 1/20 0.56
HDAC7 Q8WUI4 1/20 0.56
HDAC2 Q92769 1/20 0.56
HDAC10 Q969S8 1/20 0.56
HDAC11 Q96DB2 1/20 0.56
HDAC8 Q9BY41 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
HDAC9 Q9UKV0 1/20 0.56
HDAC5 Q9UQL6 1/20 0.56

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
SCHEMBL2218597 0.90 AR (0.66) ARPGRHDAC1
SCHEMBL7785957 0.90 AR (0.66) ARPGR
SCHEMBL2217609 0.90 AR (0.61) ARPGR
SCHEMBL16845631 0.89 AR (0.65) ARPGRHDAC3HDAC4HDAC1
SCHEMBL26451505 0.89 AR (0.65) ARPGRHDAC1
SCHEMBL4028958 0.89 AR (0.67) ARPGR
SCHEMBL12482345 0.87 AR (0.63) ARPGRHDAC3HDAC4HDAC1
SCHEMBL7779087 0.87 PGR (0.66) ARPGR
SCHEMBL3667680 0.87 PGR (0.65) ARPGR
SCHEMBL2218381 0.87 PGR (0.65) ARPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110178134-A1 Novel phenyl-substituted imidazolidines, process for preparation thereof, medicaments comprising said compounds and use thereof SANOFI-AVENTIS (FR) 2011-07-21 US disclosed
US-20110178134-A1 Novel phenyl-substituted imidazolidines, process for preparation thereof, medicaments comprising said compounds and use thereof SANOFI-AVENTIS (FR) 2011-07-21 US disclosed
US-20110178134-A1 Novel phenyl-substituted imidazolidines, process for preparation thereof, medicaments comprising said compounds and use thereof SANOFI-AVENTIS (FR) 2011-07-21 US disclosed
EP-2242745-A1 NOVEL PHENYL-SUBSTITUTED IMIDAZOLIDINES, METHOD FOR THE PRODUCTION THEREOF, MEDICAMENTS CONTAINING SAID COMPOUNDS AND USE THEREOF Sanofi-Aventis (FR) 2010-10-27 EP disclosed
WO-2009097995-A1 NOVEL PHENYL-SUBSTITUTED IMIDAZOLIDINES, METHOD FOR THE PRODUCTION THEREOF, MEDICAMENTS CONTAINING SAID COMPOUNDS AND USE THEREOF SANOFI-AVENTIS (FR) 2009-08-13 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-20110178134-A1 Novel phenyl-substituted imidazolidines, process for preparation thereof, medicaments comprising said compounds and use thereof FABP4, GPR119, PGC AR 3140/4885PGR 1833/4885HDAC3 179/4885

“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.