SCHEMBL9902892

SCHEMBL9902892

CC(=O)Oc1cc(C(=O)O)cc2scc(C)c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.47
KDM4E B2RXH2 5/20 0.47
ALDH1A1 P00352 4/20 0.47
GAA P10253 2/20 0.47
RAB9A P51151 1/20 0.47
DAO P14920 1/20 0.41
PKM P14618 3/20 0.39
MAPT P10636 2/20 0.39
CASP7 P55210 2/20 0.39
HPGD P15428 2/20 0.39
HTT P42858 2/20 0.39
MEN1 O00255 1/20 0.39
ABCC4 O15439 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
TTR P02766 1/20 0.39
TP53 P04637 1/20 0.39
HSP90AA1 P07900 1/20 0.39
CHRM2 P08172 1/20 0.39
HSP90AB1 P08238 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
SCHEMBL23755288 0.85 CA12 (0.50) TSHRRAB9ADAOPKMHTT
SCHEMBL642078 0.83 CA12 (0.42) TSHRKDM4EALDH1A1GAARAB9A
Lithium Ion SCHEMBL30122475 0.82 CA12 (0.47) TSHRALDH1A1RAB9ADAOPKM
SCHEMBL25582307 0.78 KDM4E (0.40) TSHRKDM4EALDH1A1GAARAB9A
SCHEMBL8830887 0.73 KDM4E (0.63) TSHRKDM4EALDH1A1GAARAB9A
SCHEMBL29329332 0.73 KDM4E (0.58) TSHRKDM4EALDH1A1GAARAB9A
SCHEMBL17866230 0.72 KDM4E (0.43) TSHRKDM4EALDH1A1GAARAB9A
SCHEMBL12096318 0.72 KDM4E (0.43) TSHRKDM4EALDH1A1GAARAB9A
SCHEMBL644865 0.72 KDM4E (0.53) TSHRKDM4EALDH1A1GAARAB9A
3,4,5-Triacetoxybenzoic Acid SCHEMBL716891 0.70 KDM4E (0.63) TSHRKDM4EALDH1A1GAARAB9A

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-2463283-B1 Fused phenyl Amido heterocyclic compounds for the prevention and treatment of glucokinase-mediated diseases PFIZER PROD INC (US) 2014-06-11 EP disclosed
EP-2463283-A1 Fused phenyl Amido heterocyclic compounds for the prevention and treatment of glucokinase-mediated diseases Pfizer Products Inc. (US) 2012-06-13 EP disclosed