SCHEMBL29498554

SCHEMBL29498554

Cc1cccc(S(=O)(=O)Nc2ccccc2)c1-c1cccnc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.65
TP53 P04637 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
ALPL P05186 8/20 0.50
KMT2A Q03164 2/20 0.49
EDNRA P25101 2/20 0.46
POLB P06746 2/20 0.46
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
GAA P10253 1/20 0.44
MEN1 O00255 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
EDNRB P24530 1/20 0.44
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL29498577 0.85 ALDH1A1 (0.51) ALDH1A1TP53TDP1ALPLKMT2A
SCHEMBL29498541 0.85 ALDH1A1 (0.51) ALDH1A1TP53TDP1ALPLKMT2A
SCHEMBL31368924 0.79 ALDH1A1 (1.00) ALDH1A1TP53TDP1ALPLKMT2A
SCHEMBL3448568 0.79 ALDH1A1 (1.00) ALDH1A1TP53TDP1ALPLKMT2A
SCHEMBL29498544 0.76 ALDH1A1 (0.52) ALDH1A1TP53
SCHEMBL29498509 0.75 PIK3CD (0.47) ALDH1A1TP53TDP1EDNRAHTT
SCHEMBL12464421 0.74 ALDH1A1 (0.64) ALDH1A1TP53TDP1ALPLKMT2A
SCHEMBL29498593 0.74 ALDH1A1 (0.57) ALDH1A1TP53TDP1ALPLKMT2A
SCHEMBL29498617 0.74 ALDH1A1 (0.40) ALDH1A1TP53TDP1EDNRAHTT
SCHEMBL29498618 0.74 PIK3CD (0.58) ALDH1A1TP53TDP1

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
CN-109715629-B Aza-indazole compounds for use in tendon and/or ligament injuries 诺华股份有限公司 2022-04-12 CN disclosed