SCHEMBL6138341

SCHEMBL6138341

CN(C)C1(CCCC(=O)O)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.41
OPRL1 P41146 2/20 0.41
LMNA P02545 2/20 0.40
SLC22A6 Q4U2R8 2/20 0.40
TSHR P16473 5/20 0.39
NFKB1 P19838 1/20 0.39
PMP22 Q01453 1/20 0.39
AKR1B1 P15121 1/20 0.38
GPR84 Q9NQS5 7/20 0.37
PPARG P37231 6/20 0.37
PPARD Q03181 6/20 0.37
PPARA Q07869 6/20 0.37
HDAC11 Q96DB2 5/20 0.37
ALDH1A1 P00352 2/20 0.37
TLR2 O60603 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
FABP4 P15090 2/20 0.37
PTPN1 P18031 2/20 0.37
SLC22A8 Q8TCC7 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL6138493 0.76 OPRM1 (0.39) OPRM1OPRL1LMNAKMT2A
SCHEMBL2558530 0.71 LMNA (0.46) LMNASLC22A6TSHRNFKB1PMP22
Glutarate SCHEMBL5874406 0.69 SLC22A6 (0.73) LMNASLC22A6TSHRNFKB1PMP22
Adipic Acid SCHEMBL5874870 0.69 LMNA (0.73) LMNASLC22A6TSHRNFKB1PMP22
Adipic Acid SCHEMBL5874879 0.69 LMNA (0.73) LMNASLC22A6TSHRNFKB1PMP22
Glutarate SCHEMBL5874412 0.69 SLC22A6 (0.73) LMNASLC22A6TSHRNFKB1PMP22
SCHEMBL14943788 0.68 CAMK2A (0.42) LMNASLC22A6TSHRNFKB1PMP22
SCHEMBL249726 0.67 CAMK2A (0.46) LMNASLC22A6TSHRNFKB1PMP22
Sebacic Acid SCHEMBL5874992 0.66 TSHR (0.75) LMNASLC22A6TSHRNFKB1PMP22
Trimethylammonium SCHEMBL11145139 0.66 TSHR (0.75) LMNASLC22A6TSHRNFKB1PMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1170281-B1 1,1- and 1,2-disubstituted cyclopropanes, process for their preparation and pharmaceutical compositions thereof SERVIER LAB (FR) 2005-12-21 EP claimed