SCHEMBL1996183

SCHEMBL1996183

O=C1CN(Cc2ccc(-c3ccccc3CN3CCOCC3)cc2)C(=O)N1CC1CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.40
CYP2A13 Q16696 4/20 0.39
METAP2 P50579 2/20 0.39
PDE10A Q9Y233 2/20 0.39
ENPP2 Q13822 1/20 0.38
GRM2 Q14416 1/20 0.38
DHODH Q02127 1/20 0.38
HTR7 P34969 1/20 0.37
BCL2 P10415 1/20 0.37
BCL2L1 Q07817 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL2001274 0.96 HRH3 (0.38) HRH3CYP2A13METAP2PDE10AENPP2
SCHEMBL1998864 0.90 HRH3 (0.43) HRH3ENPP2GRM2DHODHHTR7
SCHEMBL1996839 0.86 LTA4H (0.37) ENPP2GRM2
SCHEMBL2000635 0.85 METAP2 (0.42) HRH3CYP2A13METAP2PDE10AENPP2
SCHEMBL1997561 0.85 METAP2 (0.43) HRH3CYP2A13METAP2PDE10AENPP2
SCHEMBL1998644 0.84 METAP2 (0.43) HRH3CYP2A13METAP2PDE10AENPP2
SCHEMBL1998519 0.84 CYP2A13 (0.42) HRH3CYP2A13METAP2PDE10AENPP2
SCHEMBL2001280 0.84 CYP2A13 (0.42) HRH3CYP2A13METAP2PDE10AENPP2
SCHEMBL1998347 0.84 METAP2 (0.41) HRH3CYP2A13METAP2PDE10AENPP2
SCHEMBL1998382 0.83 METAP2 (0.42) HRH3CYP2A13METAP2PDE10AENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960560-B2 1-(biphenyl-4-ylmethyl)imidazolidine-2,4-dione N.V. ORGANON (NL) 2011-06-14 US claimed
US-20100144723-A1 1-(BIPHENYL-4-YLMETHYL)IMIDAZOLIDINE-2,4-DIONE N. V. ORGANON 2010-06-10 US claimed
EP-2373627-A1 1- (BIPHENYL-4-YLMETHYL) IMIDAZOLIDINE-2, 4-DIONE DERIVATIVES AND THEIR USE AS CB2 RECEPTOR AGONISTS N.V. Organon (NL) 2011-10-12 EP disclosed
US-7960560-B2 1-(biphenyl-4-ylmethyl)imidazolidine-2,4-dione N.V. ORGANON (NL) 2011-06-14 US disclosed
US-20100144723-A1 1-(BIPHENYL-4-YLMETHYL)IMIDAZOLIDINE-2,4-DIONE N. V. ORGANON 2010-06-10 US disclosed
WO-2010063721-A1 1- (BIPHENYL-4-YLMETHYL) IMIDAZOLIDINE-2, 4-DIONE DERIVATIVES AND THEIR USE AS CB2 RECEPTOR AGONISTS N.V. ORGANON (NL) 2010-06-10 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-20100144723-A1 1-(BIPHENYL-4-YLMETHYL)IMIDAZOLIDINE-2,4-DIONE OPRM1, OR10J3, OPRD1 HRH3 32/4885CYP2A13 3404/4885METAP2 3694/4885

“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.