SCHEMBL1998795

SCHEMBL1998795

CC(C)CN1C(=O)CN(Cc2ccc(-c3cccc(CN4CCCCC4)c3)cc2)C1=O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
HRH3 Q9Y5N1 7/20 0.48
HRH4 Q9H3N8 1/20 0.43
ENPP2 Q13822 2/20 0.42
NMT1 P30419 2/20 0.42
AVPR1B P47901 1/20 0.41
KDM5B Q9UGL1 1/20 0.40
GRIA2 P42262 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
MCHR1 Q99705 1/20 0.40

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
SCHEMBL1997569 0.90 CYP2D6 (0.49) CYP2D6CYP2C19HRH3HRH4ENPP2
SCHEMBL2002675 0.89 DHODH (0.43) CYP2D6CYP2C19HRH3ENPP2NMT1
SCHEMBL1997193 0.86 HRH3 (0.46) CYP2D6CYP2C19HRH3HRH4ENPP2
SCHEMBL1997243 0.84 HRH3 (0.44) CYP2D6CYP2C19HRH3HRH4ENPP2
SCHEMBL1998174 0.83 CYP2D6 (0.48) CYP2D6CYP2C19HRH3HRH4ENPP2
SCHEMBL840172 0.81 HRH3 (0.41) CYP2D6CYP2C19HRH3HRH4ENPP2
SCHEMBL2001267 0.81 CHKA (0.41) CYP2D6CYP2C19HRH3HRH4ENPP2
SCHEMBL7696987 0.77 HDAC6 (0.56) ENPP2HDAC6
SCHEMBL1998338 0.75 MCHR1 (0.40) CYP2D6CYP2C19HRH3ENPP2GRIA2
SCHEMBL840270 0.75 ALDH1A1 (0.38)

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 CYP2D6 452/4885CYP2C19 1442/4885HRH3 32/4885

“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.