SCHEMBL8019167

SCHEMBL8019167

COc1ccc(N2C(=O)N(Cc3ccccc3Cc3ccccc3)C(C)(C)C2=O)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.49
TAS2R8 Q9NYW2 7/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
AR P10275 1/20 0.41
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
MCHR1 Q99705 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38

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
SCHEMBL8019165 0.91 TAS2R8 (0.44) TAS2R8HDAC1HDAC6ARHCRTR1
SCHEMBL8019174 0.89 AR (0.44) TAS2R8AR
SCHEMBL8026324 0.87 AR (0.43) TAS2R8ARMAPT
SCHEMBL8012585 0.85 TAS2R8 (0.46) CYP3A4TAS2R8HDAC1HDAC6MCHR1
SCHEMBL12603154 0.83 MCHR1 (0.50) CYP3A4TAS2R8MCHR1
SCHEMBL12603161 0.83 AR (0.45) TAS2R8ARMCHR1
SCHEMBL8019161 0.83 TAS2R8 (0.43) TAS2R8HDAC1HDAC6ARMCHR1
SCHEMBL8029468 0.83 ELANE (0.44) TAS2R8ARMAPT
SCHEMBL12603210 0.83 ITGB2 (0.46) TAS2R8AR
SCHEMBL8034783 0.83 SMO (0.45) TAS2R8AR

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 CYP3A4 75/4885TAS2R8 238/4885HDAC1 1283/4885

“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.