SCHEMBL8060665

SCHEMBL8060665

CCC1(O)CS(=O)(=O)c2cc(C(=O)OC)c(C)cc21

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.36
KDM4E B2RXH2 8/20 0.36
MAPT P10636 3/20 0.36
HSD17B10 Q99714 2/20 0.36
LMNA P02545 3/20 0.35
KMT2A Q03164 3/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 2/20 0.34
PDGFRB P09619 1/20 0.34
FGFR1 P11362 1/20 0.34
PDGFRA P16234 1/20 0.34
FLT1 P17948 1/20 0.34
FGFR3 P22607 1/20 0.34
KDR P35968 1/20 0.34
GAA P10253 2/20 0.33
GLA P06280 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL8062941 0.83 KDM4E (0.35) ALDH1A1KDM4EMAPTHSD17B10KMT2A
SCHEMBL8058138 0.81 KDM4E (0.36) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL8062769 0.77 PDGFRA (0.34) ALDH1A1KDM4EMAPTHSD17B10KMT2A
SCHEMBL8045223 0.74 RXRA (0.38) KMT2AMEN1
SCHEMBL8045123 0.73 KDM4E (0.33) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL8062907 0.71 RARA (0.39) ALDH1A1KDM4EMAPTHSD17B10LMNA
SCHEMBL8062746 0.71 RXRA (0.36) ALDH1A1KDM4EMAPTHSD17B10LMNA
SCHEMBL8045106 0.71 ALDH1A1 (0.35) ALDH1A1KDM4EMAPTHSD17B10LMNA
SCHEMBL8062776 0.70 ALDH1A1 (0.34) ALDH1A1KDM4EMAPTHSD17B10LMNA
SCHEMBL8060677 0.70 ALDH1A1 (0.34) ALDH1A1KDM4EMAPTHSD17B10LMNA

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
US-6028069-A Heterocyclyl-condensed benzoylguanidines, their production and use as inhibitors of the cellular Na+/H+-antiporter MERCK PATENT GESELLSCHAFT MIT BERSCHRANKER HAFTUNG (DE) 2000-02-22 US disclosed