SCHEMBL11477635

SCHEMBL11477635

NC1CCCCCC1N(C(=O)/C=C\Br)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 10/20 0.50
▸ ALDH1A1 P00352 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ MITF O75030 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PAX8 Q06710 1/20 0.41
▸ PKM P14618 1/20 0.35
▸ HTR2A P28223 1/20 0.34
▸ HTR2C P28335 1/20 0.34
▸ HTR2B P41595 1/20 0.34
▸ SIGMAR1 Q99720 1/20 0.34
▸ LMNA P02545 2/20 0.32
▸ MC3R P41968 1/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 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
SCHEMBL11477639 1.00 TRPM8 (0.50) TRPM8ALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL11508798 0.96 TRPM8 (0.48) TRPM8ALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL11508799 0.96 TRPM8 (0.48) TRPM8ALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL11500743 0.84 TRPM8 (0.46) TRPM8ALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL11579712 0.80 TRPM8 (0.44) TRPM8ALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL11546924 0.76 MEN1 (0.47) TRPM8ALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL11472081 0.75 TRPM8 (0.46) TRPM8ALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL11472079 0.75 TRPM8 (0.46) TRPM8ALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL11472080 0.75 LMNA (0.38) TRPM8ALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL11446742 0.72 MEN1 (0.45) TRPM8ALDH1A1SMN1; SMN2KDM4EMEN1

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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