SCHEMBL7964356

SCHEMBL7964356

CO/N=C(/CCc1nnn(C)n1)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 14/20 0.48
DRD2 P14416 8/20 0.48
SLC6A4 P31645 1/20 0.41
GAA P10253 1/20 0.34

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
SCHEMBL2434032 1.00 DRD4 (0.48) DRD4DRD2SLC6A4GAA
SCHEMBL7974740 1.00 DRD4 (0.48) DRD4DRD2SLC6A4GAA
SCHEMBL3363237 0.79 MGAM (0.45) SLC6A4GAA
SCHEMBL7977155 0.79 DRD4 (0.44) DRD4DRD2SLC6A4
SCHEMBL2438157 0.79 DRD4 (0.44) DRD4DRD2SLC6A4
SCHEMBL2433489 0.75 DRD4 (0.43) DRD4DRD2SLC6A4
SCHEMBL7974742 0.75 DRD4 (0.43) DRD4DRD2SLC6A4
SCHEMBL7963848 0.74 SLC6A4 (0.60) DRD4DRD2SLC6A4
SCHEMBL2433288 0.74 SLC6A4 (0.60) DRD4DRD2SLC6A4
SCHEMBL12293338 0.72 SLC6A4 (0.49) DRD4DRD2SLC6A4

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-20110230428-A1 CERTAIN KYNURENINE-3-MONOOXYGENASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF CHDI FOUNDATION, INC. 2011-09-22 US disclosed
US-20110230428-A1 CERTAIN KYNURENINE-3-MONOOXYGENASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF CHDI FOUNDATION, INC. 2011-09-22 US disclosed
WO-2010011302-A1 CERTAIN KYNURENINE-3-MONOOXYGENASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF CHDI, INC. (US) 2010-01-28 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-20110230428-A1 CERTAIN KYNURENINE-3-MONOOXYGENASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF KMO, KYNU, MAOA DRD4 3036/4885DRD2 2185/4885SLC6A4 670/4885

“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.