SCHEMBL11338282

SCHEMBL11338282

CN(C)C1CCCCCC1N(C(=S)CCCl)c1ccc(Cl)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ NPC1 O15118 3/20 0.36
▸ POLB P06746 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ PSEN1 P49768 1/20 0.34
▸ PSEN2 P49810 1/20 0.34
▸ APH1B Q8WW43 1/20 0.34
▸ NCSTN Q92542 1/20 0.34
▸ APH1A Q96BI3 1/20 0.34
▸ PSENEN Q9NZ42 1/20 0.34
▸ LMNA P02545 2/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ SLC6A4 P31645 1/20 0.33

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
SCHEMBL11446572 0.96 MEN1 (0.34) MEN1KMT2ANPC1POLBSIGMAR1
SCHEMBL11332175 0.84 SIGMAR1 (0.42) MEN1KMT2ANPC1POLBSIGMAR1
SCHEMBL11446841 0.80 SIGMAR1 (0.40) MEN1KMT2ANPC1POLBSIGMAR1
Fumaric Acid SCHEMBL11332169 0.78 MEN1 (0.39) MEN1KMT2ANPC1SIGMAR1CNR2
SCHEMBL11338281 0.77 ALDH1A1 (0.40) MEN1KMT2ANPC1SIGMAR1LMNA
SCHEMBL11347007 0.76 SIGMAR1 (0.43) MEN1KMT2ANPC1POLBSIGMAR1
SCHEMBL11341133 0.75 RAB9A (0.40) MEN1KMT2ANPC1POLBSIGMAR1
SCHEMBL11346088 0.75 SIGMAR1 (0.37) MEN1KMT2ANPC1SIGMAR1CNR2
SCHEMBL11344631 0.75 MEN1 (0.36) MEN1KMT2APOLBSIGMAR1LMNA
SCHEMBL11330943 0.74 MEN1 (0.40) MEN1KMT2ANPC1SIGMAR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4156014-A N-(2-aminocycloheptyl)alkanoylanilides and in the treatment of depression THE UPJOHN COMPANY (US) 1979-05-22 — — US claimed
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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