SCHEMBL1997408

SCHEMBL1997408

O=C1CN(Cc2ccc(-c3cccc(CN4CCSCC4)c3)cc2)C(=O)N1C1CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 3/20 0.49
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HRH3 Q9Y5N1 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTR5A P47898 1/20 0.37
POLB P06746 1/20 0.37
OPRM1 P35372 1/20 0.36
OPRK1 P41145 1/20 0.36
OPRL1 P41146 1/20 0.36
LSS P48449 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36

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
SCHEMBL1999482 0.87 ENPP2 (0.48) ENPP2MEN1KMT2AHRH3CYP2D6
SCHEMBL2000525 0.83 ENPP2 (0.52) ENPP2MEN1KMT2AHRH3CYP2D6
SCHEMBL2001798 0.81 ENPP2 (0.51) ENPP2MEN1KMT2AKDM4EALDH1A1
SCHEMBL1998174 0.73 CYP2D6 (0.48) ENPP2HRH3CYP2D6CYP2C19
SCHEMBL1998349 0.72 ENPP2 (0.48) ENPP2HRH3CYP2D6CYP2C19DRD2
SCHEMBL1998795 0.71 CYP2D6 (0.49) ENPP2HRH3CYP2D6CYP2C19
SCHEMBL1997569 0.71 CYP2D6 (0.49) ENPP2KDM4EALDH1A1HRH3CYP2D6
SCHEMBL1998115 0.71 LMNA (0.41) ENPP2MEN1KMT2AHRH3CYP2D6
SCHEMBL1815295 0.70 ENPP2 (0.53) ENPP2
SCHEMBL2000857 0.70 ENPP2 (0.53) ENPP2MEN1KMT2AHRH3

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 4 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
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

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 ENPP2 1556/4885MEN1 3145/4885KMT2A 1431/4885

“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.