SCHEMBL11338397

SCHEMBL11338397

CN(C)C1CCCCCC1O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 4/20 0.44
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA4 P22748 2/20 0.42
FAAH O00519 1/20 0.32
PHGDH O43175 1/20 0.32
MGLL Q99685 1/20 0.32
TSHR P16473 1/20 0.32
KCNA5 P22460 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
LTA4H P09960 2/20 0.31
GSR P00390 1/20 0.30

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
SCHEMBL11338392 1.00 SLC18A3 (0.44) SLC18A3CA1CA2CA4FAAH
SCHEMBL11338394 1.00 SLC18A3 (0.44) SLC18A3CA1CA2CA4FAAH
SCHEMBL3088065 0.97 SLC18A3 (0.46) SLC18A3CA1CA2CA4TSHR
SCHEMBL3087522 0.97 SLC18A3 (0.46) SLC18A3CA1CA2CA4TSHR
SCHEMBL20095903 0.97 SLC18A3 (0.46) SLC18A3CA1CA2CA4TSHR
SCHEMBL2453564 0.97 SLC18A3 (0.46) SLC18A3CA1CA2CA4TSHR
SCHEMBL3083346 0.97 SLC18A3 (0.46) SLC18A3CA1CA2CA4TSHR
SCHEMBL3081603 0.97 SLC18A3 (0.46) SLC18A3CA1CA2CA4TSHR
SCHEMBL3083341 0.97 SLC18A3 (0.46) SLC18A3CA1CA2CA4TSHR
SCHEMBL23275886 0.92

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE30837-E ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1981-12-29 US disclosed
US-4199589-A N-(2-Aminocycloheptyl)acylanilides and methods to treat depression SZMUSZKOVICZ JACOB (US) 1980-04-22 US disclosed
US-4172898-A N-(2-aminocycloheptyl)acylanilides THE UPJOHN COMPANY (US) 1979-10-30 US disclosed
US-4169156-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1979-09-25 US disclosed
US-4159339-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1979-06-26 US disclosed
US-4156014-A N-(2-aminocycloheptyl)alkanoylanilides and in the treatment of depression THE UPJOHN COMPANY (US) 1979-05-22 US disclosed