SCHEMBL9738440

SCHEMBL9738440

CCCCNC(=O)Oc1ccc2c(ccn2N(CCC)c2ccncc2)c1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.66
BCHE P06276 3/20 0.55
MGLL Q99685 1/20 0.41

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
Hydrochloric Acid SCHEMBL8537931 0.99 SLC6A2 (0.65) SLC6A2BCHEMGLL
SCHEMBL8539705 0.96 SLC6A2 (0.64) SLC6A2BCHEMGLL
SCHEMBL8544459 0.95 SLC6A2 (0.67) SLC6A2BCHE
SCHEMBL9738329 0.92 SLC6A2 (0.69) SLC6A2BCHE
Hydrochloric Acid SCHEMBL8542999 0.91 SLC6A2 (0.67) SLC6A2BCHE
SCHEMBL9738471 0.89 SLC6A2 (0.60) SLC6A2BCHE
SCHEMBL8538709 0.89 SLC6A2 (0.70) SLC6A2BCHE
Hydrochloric Acid SCHEMBL8541408 0.89 SLC6A2 (0.59) SLC6A2BCHE
SCHEMBL8539588 0.88 SLC6A2 (0.50) SLC6A2BCHEMGLL
Hydrochloric Acid SCHEMBL8544161 0.87 SLC6A2 (0.49) SLC6A2BCHEMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5102891-A Useful for treating various memory dysfunctions such as alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1992-04-07 US claimed
US-5102891-A Useful for treating various memory dysfunctions such as alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1992-04-07 US disclosed