SCHEMBL2413826

SCHEMBL2413826

NC[C@H]1CCN([C@@H]2Cc3ccccc3[C@H]2Oc2ccc(Cl)cc2Br)C1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC9A3 P48764 16/20 0.47
▸ TRPC6 Q9Y210 2/20 0.47
▸ TRPC3 Q13507 1/20 0.47
▸ TRPC7 Q9HCX4 1/20 0.47
▸ CYP2D6 P10635 6/20 0.46
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ KMT2A Q03164 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
SCHEMBL12290636 1.00 SLC9A3 (0.47) SLC9A3TRPC6TRPC3TRPC7CYP2D6
SCHEMBL2408570 0.90 TRPC6 (0.55) SLC9A3TRPC6TRPC3TRPC7CYP2D6
SCHEMBL12290638 0.90 TRPC6 (0.49) SLC9A3TRPC6TRPC3TRPC7CYP2D6
SCHEMBL12291258 0.90 TRPC6 (0.49) SLC9A3TRPC6TRPC3TRPC7CYP2D6
SCHEMBL2369936 0.86 TRPC6 (0.54) SLC9A3TRPC6TRPC3TRPC7CYP2D6
SCHEMBL2413989 0.86 TRPC6 (0.58) SLC9A3TRPC6TRPC3TRPC7CYP2D6
SCHEMBL2409989 0.86 TRPC6 (0.56) SLC9A3TRPC6TRPC3TRPC7CYP2D6
SCHEMBL2409067 0.86 TRPC6 (0.56) SLC9A3TRPC6TRPC3TRPC7CYP2D6
SCHEMBL12291653 0.84 TRPC6 (0.52) SLC9A3TRPC6TRPC3TRPC7CYP2D6
SCHEMBL2409077 0.84 TRPC6 (0.52) SLC9A3TRPC6TRPC3TRPC7CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130131034-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-05-23 — — US claimed
EP-2542524-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-01-09 — — EP claimed
EP-2368876-A1 Derivatives of aminoindanes, their preparation and their application in therapeutics SANOFI (FR) 2011-09-28 — — EP claimed
US-20130131034-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-05-23 — — US disclosed
US-20130131034-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-05-23 — — US disclosed
US-20130131034-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-05-23 — — US disclosed
EP-2542524-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-01-09 — — EP disclosed
EP-2368876-A1 Derivatives of aminoindanes, their preparation and their application in therapeutics SANOFI (FR) 2011-09-28 — — EP 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-20130131034-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS ANXA2, ANXA3, ADM2 SLC9A3 1898/4885TRPC6 3080/4885TRPC3 2333/4885

“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.

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