SCHEMBL8327501

SCHEMBL8327501

CCN(CC#Cc1ccc(C2CCCCC2)c(Cl)c1)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.39
TMEM97 Q5BJF2 1/20 0.39
EBP Q15125 1/20 0.39
CNR2 P34972 1/20 0.31

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
Hydrochloric Acid SCHEMBL7314180 0.99 SIGMAR1 (0.38) SIGMAR1TMEM97EBPCNR2
SCHEMBL29412738 0.78 SIGMAR1 (0.56) SIGMAR1TMEM97EBP
SCHEMBL7325355 0.78 SIGMAR1 (0.56) SIGMAR1TMEM97EBP
Hydrochloric Acid SCHEMBL9148670 0.77 SIGMAR1 (0.55) SIGMAR1TMEM97EBP
SCHEMBL8327508 0.76 ALDH1A1 (0.32) CNR2
SCHEMBL26765552 0.75 SIGMAR1 (0.44) SIGMAR1TMEM97EBP
SCHEMBL8469003 0.75 SIGMAR1 (0.40) SIGMAR1TMEM97EBPCNR2
SCHEMBL7318786 0.75 SIGMAR1 (0.64) SIGMAR1TMEM97EBPCNR2
SCHEMBL7318790 0.75 SIGMAR1 (0.64) SIGMAR1TMEM97EBPCNR2
SCHEMBL7318797 0.75 SIGMAR1 (0.64) SIGMAR1TMEM97EBPCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1154483-C Use of amines to produce drugs for preventing tumour cell proliferation ��ŵ��-ʥ�������ɷ����޹�˾ 2004-06-23 CN disclosed
CN-1226825-A Use of amines to produce drugs for preventing tumour cell proliferation SANOFI SA (FR) 1999-08-25 CN disclosed
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