SCHEMBL9155328

SCHEMBL9155328

CCCC(c1ccncc1)n1ccc2cc(OC(=O)N(C)C)ccc21

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.56
ITGB3 P05106 6/20 0.42
ITGAV P06756 6/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
NCEH1 Q6PIU2 1/20 0.39
CNR2 P34972 2/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ITGB5 P18084 1/20 0.37
RAB9A P51151 1/20 0.36
ACHE P22303 3/20 0.35
BCHE P06276 1/20 0.35

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
SCHEMBL8845716 0.89 SLC6A2 (0.55) SLC6A2ITGB3ITGAVMAOAMAOB
SCHEMBL8845539 0.86 SLC6A2 (0.56) SLC6A2ITGB3ITGAVMAOAITGB5
SCHEMBL9197969 0.82 SLC6A2 (0.65) SLC6A2ITGB3ITGAV
SCHEMBL9196729 0.82 SLC6A2 (0.52) SLC6A2ITGB3ITGAVCNR2MEN1
SCHEMBL8845725 0.80 SLC6A2 (0.54) SLC6A2ITGB3ITGAVCNR2ITGB5
SCHEMBL8845540 0.80 SLC6A2 (0.49) SLC6A2ITGB3ITGAVKMT2AITGB5
Oxalic Acid SCHEMBL9196754 0.79 SLC6A2 (0.57) SLC6A2ITGB3ITGAVMEN1KMT2A
SCHEMBL8845768 0.78 SLC6A2 (0.68) SLC6A2ITGB3ITGAVMEN1KMT2A
SCHEMBL9201233 0.77 SLC6A2 (0.70) SLC6A2ITGB3ITGAV
SCHEMBL9194455 0.76 SLC6A2 (0.63) SLC6A2ITGB3ITGAVMEN1KMT2A

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
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
EP-0471298-A1 Carbamoyl-1-(pyridinylalkyl)-1H-indoles, indolines and related analogs HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-02-19 EP disclosed