SCHEMBL8015688

SCHEMBL8015688

CC(C)(C)c1ccccc1N1C(=O)N(Cc2ccccc2Cc2ccccc2)C(C)(C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
AR P10275 1/20 0.39
TAS2R8 Q9NYW2 7/20 0.37
NR1H2 P55055 1/20 0.36
IGF1R P08069 4/20 0.35
ELANE P08246 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL12603206 0.90 AR (0.47) HDAC1HDAC6ARIGF1RALDH1A1
SCHEMBL8031790 0.88 NR1H2 (0.47) HDAC1HDAC6ARTAS2R8NR1H2
SCHEMBL8027996 0.86 TAS2R8 (0.43) HDAC1HDAC6ARTAS2R8NR1H2
SCHEMBL8030961 0.84 HTR1A (0.43) HDAC1HDAC6ARTAS2R8NR1H2
SCHEMBL8026303 0.84 HDAC1 (0.41) HDAC1HDAC6ARTAS2R8NR1H2
SCHEMBL8032968 0.84 NR1H2 (0.43) HDAC1HDAC6ARTAS2R8NR1H2
SCHEMBL8032943 0.83 HDAC1 (0.40) HDAC1HDAC6ARTAS2R8NR1H2
SCHEMBL8021543 0.83 TAS2R8 (0.41) HDAC1HDAC6ARTAS2R8NR1H2
SCHEMBL12603180 0.82 HDAC1 (0.39) HDAC1HDAC6ARTAS2R8NR1H2
SCHEMBL8015272 0.82 HDAC1 (0.59) HDAC1HDAC6TAS2R8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110112097-A1 Substituted imidazoline-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof SANOFI-AVENTIS (FR) 2011-05-12 US disclosed
US-20110112097-A1 Substituted imidazoline-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof SANOFI-AVENTIS (FR) 2011-05-12 US disclosed
WO-2009097997-A1 SUBSTITUTED IMIDAZOLIDINE-2,4-DIONES, 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-20110112097-A1 Substituted imidazoline-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof GIPR, PGC, DDC HDAC1 1283/4885HDAC6 2453/4885AR 2449/4885

“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.