SCHEMBL11472079

SCHEMBL11472079

N[C@@H]1CC(Cl)CCC[C@H]1N(C(=O)C=CCl)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 7/20 0.46
▸ ALDH1A1 P00352 3/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ MITF O75030 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ HTR2A P28223 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ CHRM2 P08172 3/20 0.34
▸ CHRM3 P20309 3/20 0.34
▸ MAOA P21397 2/20 0.33
▸ KDM1A O60341 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.32

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
SCHEMBL11472081 1.00 TRPM8 (0.46) TRPM8ALDH1A1SMN1; SMN2MITFKDM4E
SCHEMBL11472015 0.87 TRPM8 (0.41) TRPM8ALDH1A1SMN1; SMN2MITFKDM4E
SCHEMBL11472017 0.87 TRPM8 (0.41) TRPM8ALDH1A1SMN1; SMN2MITFKDM4E
SCHEMBL11338200 0.86 TRPM8 (0.43) TRPM8ALDH1A1SMN1; SMN2MITFKDM4E
SCHEMBL11478753 0.86 TRPM8 (0.43) TRPM8ALDH1A1SMN1; SMN2MITFKDM4E
SCHEMBL11468500 0.82 TRPM8 (0.40) TRPM8ALDH1A1SMN1; SMN2MITFKDM4E
SCHEMBL11472016 0.81 LMNA (0.37) TRPM8ALDH1A1SMN1; SMN2MITFKDM4E
SCHEMBL11508799 0.79 TRPM8 (0.48) TRPM8ALDH1A1SMN1; SMN2MITFKDM4E
SCHEMBL11447951 0.79 TRPM8 (0.42) TRPM8ALDH1A1SMN1; SMN2MITFKDM4E
SCHEMBL11508798 0.79 TRPM8 (0.48) TRPM8ALDH1A1SMN1; SMN2MITFKDM4E

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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