SCHEMBL6012832

SCHEMBL6012832

CCCc1nc(N)c(C(=O)OC)c(-c2ccccc2)c1C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 5/20 0.46
LMNA P02545 4/20 0.46
KDM4E B2RXH2 4/20 0.46
HPGD P15428 4/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 3/20 0.46
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TP53 P04637 2/20 0.44
HSD17B10 Q99714 2/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
PRKCZ Q05513 1/20 0.42
AR P10275 1/20 0.41
GRM6 O15303 1/20 0.41
GRM5 P41594 1/20 0.41
PLA2G2A P14555 1/20 0.41
ADORA3 P0DMS8 1/20 0.41

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
SCHEMBL6013125 0.83 GRM6 (0.46) SMN1; SMN2ALDH1A1LMNAKDM4EHPGD
SCHEMBL14616739 0.79 SMN1; SMN2 (0.73) SMN1; SMN2ALDH1A1LMNAKDM4EHPGD
SCHEMBL5108388 0.76 GCGR (0.50) SMN1; SMN2ALDH1A1LMNAKDM4EHPGD
SCHEMBL6012756 0.76 GCGR (0.43) SMN1; SMN2ALDH1A1LMNAKDM4ERAB9A
SCHEMBL6013263 0.74 GCGR (0.48) SMN1; SMN2ALDH1A1LMNAKDM4ERAB9A
SCHEMBL11494053 0.73 KDM4E (0.73) SMN1; SMN2ALDH1A1LMNAKDM4EHPGD
SCHEMBL6012892 0.73 GCGR (0.41) SMN1; SMN2ALDH1A1LMNAKDM4EHPGD
SCHEMBL6012859 0.73 GCGR (0.50) SMN1; SMN2ALDH1A1LMNAKDM4EHPGD
SCHEMBL5166558 0.71 SMN1; SMN2 (0.75) SMN1; SMN2ALDH1A1LMNAKDM4EHPGD
SCHEMBL8254104 0.71 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1LMNAHPGDMAPT

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-1684754-A1 HMG-COA REDUCTASE INHIBITORS AND METHOD Bristol-Myers Squibb Company (US) 2006-08-02 EP disclosed
WO-2005051386-A1 HMG-COA REDUCTASE INHIBITORS AND METHOD BRISTOL-MYERS SQUIBB COMPANY (US) 2005-06-09 WO disclosed