SCHEMBL8845540

SCHEMBL8845540

CCCC(c1ccncc1)n1ccc2cc(OC(=O)NN3CCCCC3)ccc21

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.49
ITGB3 P05106 10/20 0.42
ITGAV P06756 10/20 0.42
LIPE Q05469 2/20 0.40
KMT2A Q03164 1/20 0.38
ITGB5 P18084 1/20 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
SCHEMBL9196729 0.86 SLC6A2 (0.52) SLC6A2ITGB3ITGAVKMT2AITGB5
SCHEMBL8845539 0.86 SLC6A2 (0.56) SLC6A2ITGB3ITGAVITGB5
SCHEMBL8845665 0.83 LIPE (0.43) SLC6A2ITGB3ITGAVLIPEITGB5
SCHEMBL8845725 0.80 SLC6A2 (0.54) SLC6A2ITGB3ITGAVITGB5
SCHEMBL9155328 0.80 SLC6A2 (0.56) SLC6A2ITGB3ITGAVKMT2AITGB5
SCHEMBL8845735 0.78 SLC6A2 (0.49) SLC6A2ITGB3ITGAVITGB5
SCHEMBL8845528 0.78 FAAH (0.48) ITGB3ITGAV
SCHEMBL9197969 0.77 SLC6A2 (0.65) SLC6A2ITGB3ITGAV
SCHEMBL9672902 0.77 SLC6A2 (0.62) SLC6A2LIPE
SCHEMBL8845716 0.76 SLC6A2 (0.55) SLC6A2ITGB3ITGAVLIPEKMT2A

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-5688816-A COGNITION ACTIVATOR; ALZHEIMER'S DISEASE HOECHST MARION ROUSSEL, INC. (US) 1997-11-18 US 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