SCHEMBL2156930

SCHEMBL2156930

Cc1ccc(S(=O)(=O)OC[C@@]2(Cc3ccccc3)COC(C)(C)N2C(=O)O)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.39
PKM P14618 2/20 0.39
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
ELANE P08246 1/20 0.36
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
NR3C1 P04150 1/20 0.35
CYP2C19 P33261 1/20 0.35
STAT3 P40763 1/20 0.35

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
SCHEMBL2156350 0.89 ALDH1A1 (0.41) GAAKMT2AMEN1MAPTLMNA
SCHEMBL1319262 0.77 GAA (0.42) GAAPKMNR3C1CYP2C19
SCHEMBL82964 0.76 GAA (0.42) GAAPKMNR3C1CYP2C19
SCHEMBL28753759 0.74 ALDH1A1 (0.33) KMT2AMEN1ELANEMAPT
SCHEMBL9467353 0.69 BCHE (0.41) GAAKMT2ALMNAHTTNR3C1
SCHEMBL28310610 0.69 KMT2A (0.43) GAAPKMKMT2AMEN1LMNA
SCHEMBL5535445 0.69 STAT3 (0.40) GAAKMT2AELANELMNAHTT
SCHEMBL3807712 0.69 STAT3 (0.40) GAAKMT2AELANELMNAHTT
SCHEMBL3807715 0.69 STAT3 (0.40) GAAKMT2AELANELMNAHTT
SCHEMBL2156927 0.67 ELANE (0.44) ELANEMAPTLMNA

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-7973026-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2011-07-05 US disclosed