SCHEMBL8845768

SCHEMBL8845768

CCCC(c1ccncc1)n1ccc2cc(O)ccc21

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.68
SLC6A4 P31645 3/20 0.38
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ITGB3 P05106 1/20 0.36
ITGAV P06756 1/20 0.36
CYP17A1 P05093 5/20 0.35
MAPT P10636 2/20 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
SCHEMBL9201233 0.86 SLC6A2 (0.70) SLC6A2SLC6A4ITGB3ITGAVCYP17A1
SCHEMBL9197969 0.82 SLC6A2 (0.65) SLC6A2SLC6A4ITGB3ITGAVCYP17A1
SCHEMBL9195174 0.81 SLC6A2 (1.00) SLC6A2SLC6A4CYP17A1
SCHEMBL9192640 0.79 SLC6A2 (0.57) SLC6A2KDM4EMEN1GAAKMT2A
SCHEMBL9194455 0.79 SLC6A2 (0.63) SLC6A2SLC6A4MEN1KMT2AITGB3
SCHEMBL9155328 0.78 SLC6A2 (0.56) SLC6A2MEN1KMT2AITGB3ITGAV
SCHEMBL8845539 0.78 SLC6A2 (0.56) SLC6A2SLC6A4ALDH1A1ITGB3ITGAV
Oxalic Acid SCHEMBL9196754 0.77 SLC6A2 (0.57) SLC6A2MEN1KMT2AITGB3ITGAV
SCHEMBL8845698 0.77 SLC6A2 (0.68) SLC6A2SLC6A4ALDH1A1CYP17A1MAPT
SCHEMBL14977607 0.76 BRD4 (0.47) SLC6A2SLC6A4KDM4EMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0471296-B1 1-(Pyridinylalkyl)-1H-indoles, indolines and related analogs HOECHST ROUSSEL PHARMA (US) 1995-11-08 EP claimed
US-5214058-A Acetylcholinesterase inhibitors, treatment of senile dementia HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-05-25 US claimed
EP-0471296-A1 1-(Pyridinylalkyl)-1H-indoles, indolines and related analogs HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-02-19 EP claimed
US-5688816-A COGNITION ACTIVATOR; ALZHEIMER'S DISEASE HOECHST MARION ROUSSEL, INC. (US) 1997-11-18 US disclosed
EP-0471296-B1 1-(Pyridinylalkyl)-1H-indoles, indolines and related analogs HOECHST ROUSSEL PHARMA (US) 1995-11-08 EP disclosed
EP-0471298-B1 Carbamoyl-1-(pyridinylalkyl)-1H-indoles, indolines and related analogs HOECHST ROUSSEL PHARMA (US) 1995-11-02 EP disclosed
US-5455245-A Alzheimer*s disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-10-03 US disclosed
US-5264442-A For treating alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-11-23 US disclosed
US-5214058-A Acetylcholinesterase inhibitors, treatment of senile dementia HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-05-25 US disclosed
EP-0471298-A1 Carbamoyl-1-(pyridinylalkyl)-1H-indoles, indolines and related analogs HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-02-19 EP disclosed
EP-0471296-A1 1-(Pyridinylalkyl)-1H-indoles, indolines and related analogs HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-02-19 EP disclosed