SCHEMBL7320685

SCHEMBL7320685

CCN(CC)C(=O)C1CC1c1ccc(C2CCCCC2)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.42
TMEM97 Q5BJF2 1/20 0.42
EBP Q15125 1/20 0.42
PPARG P37231 2/20 0.35
PPARA Q07869 1/20 0.35
PTGDR Q13258 3/20 0.34
PTGDR2 Q9Y5Y4 3/20 0.34
OPRL1 P41146 1/20 0.34
GPR88 Q9GZN0 1/20 0.34
PTGER2 P43116 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
ALOX15 P16050 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34

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
SCHEMBL7324009 0.88 SIGMAR1 (0.44) SIGMAR1TMEM97EBPOPRL1LMNA
SCHEMBL7324686 0.87 CNR2 (0.39) SIGMAR1TMEM97EBPPPARGPPARA
SCHEMBL7321171 0.85 GPR88 (0.44) GPR88
SCHEMBL7319274 0.83 CNR2 (0.42) SIGMAR1TMEM97EBPOPRL1SMN1; SMN2
SCHEMBL7315840 0.82 CEL (0.38) SIGMAR1TMEM97EBPPTGDRPTGDR2
SCHEMBL7312887 0.81 FFAR1 (0.44) PTGDRPTGDR2PTGER2
SCHEMBL7323035 0.81 SLC6A4 (0.43) SMN1; SMN2
Hydrochloric Acid SCHEMBL7315858 0.80 FFAR1 (0.43) PTGDRPTGDR2PTGER2
SCHEMBL7315921 0.79 APP (0.41) GPR88
SCHEMBL7322549 0.76 SIGMAR1 (0.48) SIGMAR1LMNA

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 5 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
US-6235791-B1 USING CIS N-CYCLOHEXYL-N-ETHYL(3-(3-CHLORO-CYCLOHEXYLPHENYL)ALLYL)AMINE SANOFI-SYNTHELABO (FR) 2001-05-22 US 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