SCHEMBL3518323

SCHEMBL3518323

C=CCN1CCCC[C@@H]1[C@H](N)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 8/20 0.46
SLC6A2 P23975 4/20 0.46
SLC6A4 P31645 4/20 0.46
OPRM1 P35372 6/20 0.37
OPRD1 P41143 6/20 0.37
OPRK1 P41145 6/20 0.37
OPRL1 P41146 6/20 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
SCHEMBL3516176 1.00 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4OPRM1OPRD1
SCHEMBL4727093 0.87 SLC6A2 (0.36) SLC6A3SLC6A2SLC6A4
SCHEMBL4727094 0.87 SLC6A2 (0.36) SLC6A3SLC6A2SLC6A4
SCHEMBL4727088 0.87 SLC6A2 (0.36) SLC6A3SLC6A2SLC6A4
SCHEMBL3745512 0.86 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4
SCHEMBL3515881 0.86 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4
SCHEMBL3515884 0.86 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4
SCHEMBL3514322 0.85 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4
SCHEMBL3517323 0.85 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4
SCHEMBL3514320 0.85 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298377-A1 NOVEL SUBSTITUTED INDAZOLES, THE PREPARATION THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2010-11-25 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-20100298377-A1 NOVEL SUBSTITUTED INDAZOLES, THE PREPARATION THEREOF AND USE OF SAME IN THERAPEUTICS WEE1, PRMT1, ABL1 SLC6A3 3560/4885SLC6A2 3752/4885SLC6A4 3890/4885

“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.