SCHEMBL16359263

SCHEMBL16359263

CCC(=O)CC1CCCO1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 2/20 0.43
POLB P06746 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.42
ALOX12 P18054 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL30736234 0.94 HPGD (0.42) HPGDKMT2ALMNAPOLBSMN1; SMN2
SCHEMBL28364585 0.87 HPGD (0.49) HPGDKMT2ALMNAPOLBSMN1; SMN2
SCHEMBL28038127 0.84 KMT2A (0.44) HPGDKMT2ALMNAPOLBSMN1; SMN2
SCHEMBL18598234 0.82 LMNA (0.46) HPGDKMT2ALMNAPOLBSMN1; SMN2
SCHEMBL23668692 0.81 HPGD (0.47) HPGDKMT2ALMNAPOLBSMN1; SMN2
SCHEMBL23691384 0.81 HPGD (0.47) HPGDKMT2ALMNAPOLBSMN1; SMN2
SCHEMBL23668701 0.81 HPGD (0.47) HPGDKMT2ALMNAPOLBSMN1; SMN2
SCHEMBL23668706 0.81 HPGD (0.47) HPGDKMT2ALMNAPOLBSMN1; SMN2
SCHEMBL29144661 0.81 LMNA (0.45) HPGDKMT2ALMNAPOLBSMN1; SMN2
SCHEMBL22235702 0.80 HPGD (0.44) HPGDKMT2ALMNAPOLBSMN1; SMN2

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
WO-2015005901-A1 COMBINATIONS OF HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-01-15 WO disclosed
WO-2013106520-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2013-07-18 WO disclosed