SCHEMBL9199025

SCHEMBL9199025

CCCC(c1ccncc1OC)n1ccc2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 12/20 0.62
SLC6A4 P31645 5/20 0.40
MAPT P10636 3/20 0.38
PTGER2 P43116 1/20 0.35
TP53 P04637 1/20 0.34
BRD4 O60885 1/20 0.32

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
SCHEMBL9194863 0.83 SLC6A2 (0.65) SLC6A2SLC6A4MAPT
SCHEMBL9195174 0.77 SLC6A2 (1.00) SLC6A2SLC6A4
SCHEMBL20037238 0.72 SLC6A2 (0.57) SLC6A2SLC6A4BRD4
Hydrochloric Acid SCHEMBL3977698 0.71 SLC6A2 (0.49) SLC6A2SLC6A4MAPT
SCHEMBL20940094 0.70 AAK1 (0.36)
SCHEMBL9201002 0.69 SLC6A2 (0.43) SLC6A2
SCHEMBL16791935 0.69 CYP11B1 (0.37) TP53
SCHEMBL29412428 0.68 SLC6A2 (0.59) SLC6A2SLC6A4
SCHEMBL704340 0.68 SLC6A2 (0.59) SLC6A2SLC6A4
SCHEMBL9197969 0.67 SLC6A2 (0.65) SLC6A2SLC6A4MAPT

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-5214058-A Acetylcholinesterase inhibitors, treatment of senile dementia HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-05-25 US claimed
EP-0471296-B1 1-(Pyridinylalkyl)-1H-indoles, indolines and related analogs HOECHST ROUSSEL PHARMA (US) 1995-11-08 EP disclosed
US-5214058-A Acetylcholinesterase inhibitors, treatment of senile dementia HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-05-25 US disclosed
EP-0471296-A1 1-(Pyridinylalkyl)-1H-indoles, indolines and related analogs HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-02-19 EP disclosed