SCHEMBL11350694

SCHEMBL11350694

CCN(CCc1ccccc1)C1CCCCCC1N(C(=O)CCBr)c1ccc(Br)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ MLYCD O95822 1/20 0.44
▸ SLC18A3 Q16572 2/20 0.41
▸ CHRM2 P08172 2/20 0.40
▸ CHRM3 P20309 2/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ OPRM1 P35372 3/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39
▸ SIGMAR1 Q99720 1/20 0.39
▸ OPRD1 P41143 1/20 0.38
▸ OPRK1 P41145 1/20 0.38

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
SCHEMBL11454800 0.97 L3MBTL1 (0.43) L3MBTL1MLYCDSLC18A3CHRM2CHRM3
SCHEMBL11350690 0.84 L3MBTL1 (0.41) L3MBTL1MLYCDSLC18A3CHRM2CHRM3
SCHEMBL11454799 0.81 OPRM1 (0.41) L3MBTL1MLYCDCHRM2CHRM3MEN1
SCHEMBL11331580 0.79 SIGMAR1 (0.41) MLYCDCHRM2CHRM3MEN1KMT2A
SCHEMBL11333982 0.78 SLC18A3 (0.47) L3MBTL1MLYCDSLC18A3CHRM2CHRM3
SCHEMBL11446906 0.76 SIGMAR1 (0.39) MLYCDCHRM2CHRM3MEN1KMT2A
SCHEMBL11338362 0.76 KDM4E (0.47) L3MBTL1MLYCDCHRM2CHRM3MEN1
SCHEMBL11454500 0.75 SLC18A3 (0.46) L3MBTL1MLYCDSLC18A3CHRM2CHRM3
SCHEMBL11434873 0.74 CHRM2 (0.42) MLYCDCHRM2CHRM3MEN1KMT2A
SCHEMBL11333981 0.73 SLC18A3 (0.44) SLC18A3CHRM2CHRM3MEN1KMT2A

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
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