SCHEMBL11469308

SCHEMBL11469308

NC1CCCC1N(C(=O)C1CCCC(Cl)CC1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 2/20 0.48
▸ CHRM3 P20309 2/20 0.48
▸ HTT P42858 2/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MITF O75030 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ PAX8 Q06710 1/20 0.41
▸ LMNA P02545 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ ACHE P22303 1/20 0.34
▸ MAOA P21397 2/20 0.34
▸ KDM1A O60341 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ HPGD P15428 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
SCHEMBL11507066 0.91 CHRM2 (0.44) CHRM2CHRM3HTTMEN1KMT2A
SCHEMBL11549687 0.76 OPRM1 (0.49) CHRM3MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL11579712 0.74 TRPM8 (0.44) CHRM2CHRM3HTTMEN1KMT2A
SCHEMBL11546721 0.73 ALDH1A1 (0.49) CHRM2CHRM3HTTMEN1KMT2A
SCHEMBL11550133 0.73 ALDH1A1 (0.49) CHRM2CHRM3HTTMEN1KMT2A
SCHEMBL11472079 0.73 TRPM8 (0.46) CHRM2CHRM3HTTMEN1KMT2A
SCHEMBL11472081 0.73 TRPM8 (0.46) CHRM2CHRM3HTTMEN1KMT2A
SCHEMBL11508799 0.72 TRPM8 (0.48) CHRM2CHRM3MEN1KMT2ASMN1; SMN2
SCHEMBL11508798 0.72 TRPM8 (0.48) CHRM2CHRM3MEN1KMT2ASMN1; SMN2
SCHEMBL11446742 0.72 MEN1 (0.45) CHRM2CHRM3HTTMEN1KMT2A

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-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
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