SCHEMBL11340959

SCHEMBL11340959

CCCS(O[Cl+3]([O-])([O-])[O-])(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.36
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30
DRD2 P14416 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
HSD11B1 P28845 1/20 0.30

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
SCHEMBL3858761 0.89 TDP1 (0.38) PSIP1TDP1ALDH1A1TSHR
SCHEMBL11310449 0.86 TDP1 (0.36) TDP1ALDH1A1TSHR
SCHEMBL11342294 0.79
SCHEMBL11347077 0.74 CA9 (0.35) GAAALDH1A1TSHRSMN1; SMN2LMNA
SCHEMBL3299477 0.70 PTGS2 (0.36) PSIP1TDP1ALDH1A1TSHRMAPT
SCHEMBL3857787 0.70 PTGS2 (0.36) PSIP1TDP1ALDH1A1TSHRMAPT
SCHEMBL9003676 0.69 RECQL (0.46) TDP1ALDH1A1MEN1MAPTKMT2A
SCHEMBL108184 0.69 HTR6 (0.36) PSIP1PKMTDP1ALDH1A1TSHR
SCHEMBL3132316 0.68 LTA4H (0.53) GAAALDH1A1TSHRMAPTSMN1; SMN2
SCHEMBL11347507 0.68 BCHE (0.43) PSIP1GAAALDH1A1MEN1KMT2A

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-4251521-A HYPOGLYCEMIC AGENTS SANDOZ, INC. (US) 1981-02-17 US disclosed