SCHEMBL8329993

SCHEMBL8329993

Clc1cc(C2CC2CCCc2ccccc2)ccc1C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.37
TMEM97 Q5BJF2 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
CCR5 P51681 1/20 0.37
MFN2 O95140 1/20 0.36
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35

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
SCHEMBL7322425 0.81 SLC6A4 (0.41) TMEM97SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL7326142 0.81 CCR5 (0.47) CCR5SLC6A2SLC6A4SLC6A3
SCHEMBL7319768 0.79 SLC6A4 (0.45) TMEM97SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL7323873 0.76 ALDH1A1 (0.46) SIGMAR1CCR5SLC6A2SLC6A4
SCHEMBL7317480 0.75 CCR5 (0.51) CCR5
SCHEMBL7325407 0.74 SLC6A4 (0.41) TMEM97SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL7319083 0.73 DRD2 (0.42) SLC6A4
SCHEMBL7323813 0.73 SIGMAR1 (0.46) SIGMAR1
SCHEMBL7315921 0.73 APP (0.41) FFAR4SLC6A4SLC6A3
SCHEMBL7326195 0.72 SLC6A4 (0.52) TMEM97SIGMAR1SLC6A2SLC6A4SLC6A3

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
EP-0917464-A1 USE OF AMINES TO PRODUCE DRUGS FOR PREVENTING TUMOUR CELL PROLIFERATION SANOFI (FR) 1999-05-26 EP disclosed
WO-1998004251-A1 USE OF AMINES TO PRODUCE DRUGS FOR PREVENTING TUMOUR CELL PROLIFERATION SANOFI (FR) 1998-02-05 WO disclosed