SCHEMBL7085229

SCHEMBL7085229

O=S(=O)(c1ccc(O)c2ccccc12)c1ccc(O)c2ccccc12

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.73
IDO1 P14902 4/20 0.59
ALPL P05186 1/20 0.58
ALPI P09923 1/20 0.58
ALPG P10696 1/20 0.58
DNMT1 P26358 1/20 0.58
MCL1 Q07820 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
CDK2 P24941 1/20 0.55
EP300 Q09472 2/20 0.48
KAT2B Q92831 2/20 0.48
KAT8 Q9H7Z6 2/20 0.48
HKDC1 Q2TB90 2/20 0.47
TNNI3 P19429 1/20 0.47
TNNT2 P45379 1/20 0.47
TNNC1 P63316 1/20 0.47
HDAC3 O15379 1/20 0.46
NCOR2 Q9Y618 1/20 0.46
MEN1 O00255 1/20 0.44

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
SCHEMBL7196563 0.92 LDHA (0.63) LDHAIDO1ALPLALPIALPG
SCHEMBL9718261 0.89 LDHA (0.59) LDHAIDO1ALPLALPIALPG
SCHEMBL10693393 0.88 LDHA (0.63) LDHAIDO1ALPLALPIALPG
SCHEMBL4593546 0.85 LDHA (0.59) LDHAIDO1ALPLALPIALPG
SCHEMBL29564390 0.84 LDHA (0.70) LDHAIDO1CDK2EP300KAT2B
SCHEMBL1805457 0.84 LDHA (1.00) LDHAIDO1MCL1CDK2EP300
SCHEMBL249254 0.84 LDHA (0.70) LDHAIDO1CDK2EP300KAT2B
SCHEMBL565346 0.83 LDHA (0.68) LDHAIDO1CDK2EP300KAT2B
Ammonia Solution, Strong SCHEMBL16413079 0.83 LDHA (0.68) LDHAIDO1CDK2EP300KAT2B
SCHEMBL11351489 0.83 LDHA (0.68) LDHAIDO1ALPLALPIALPG

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-20030191023-A1 Thermosensitive recording material FUJI PHOTO FILM CO., LTD. 2003-10-09 US disclosed