SCHEMBL27322855

SCHEMBL27322855

Cc1cccc(I)c1S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.36
KDM4E B2RXH2 2/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
ALDH1A1 P00352 6/20 0.36
FABP3 P05413 1/20 0.34
FABP4 P15090 1/20 0.34
FABP5 Q01469 1/20 0.34
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TSHR P16473 2/20 0.33
SLC9A1 P19634 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
TRPA1 O75762 2/20 0.32
ATM Q13315 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
HSD17B10 Q99714 3/20 0.32
HPGD P15428 2/20 0.32

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
SCHEMBL3134540 0.84 TSHR (0.40) TDP1KDM4EPOLBAPEX1ALDH1A1
SCHEMBL183903 0.84 ALDH1A1 (0.43) TDP1KDM4EPOLBAPEX1ALDH1A1
Iodide SCHEMBL27949560 0.82 ALDH1A1 (0.42) TDP1KDM4EPOLBAPEX1ALDH1A1
Hydrochloric Acid SCHEMBL8629651 0.82 ALDH1A1 (0.42) TDP1KDM4EPOLBAPEX1ALDH1A1
SCHEMBL27841017 0.82 ALDH1A1 (0.42) TDP1KDM4EPOLBAPEX1ALDH1A1
Water SCHEMBL8773033 0.82 ALDH1A1 (0.42) TDP1KDM4EPOLBAPEX1ALDH1A1
SCHEMBL27764997 0.82 ALDH1A1 (0.42) TDP1KDM4EPOLBAPEX1ALDH1A1
SCHEMBL11076120 0.82 ALDH1A1 (0.42) TDP1KDM4EPOLBAPEX1ALDH1A1
Benzene SCHEMBL28947691 0.82 TDP1 (0.44) TDP1KDM4EPOLBAPEX1ALDH1A1
Fluoromethane SCHEMBL27938455 0.80 ALDH1A1 (0.40) TDP1KDM4EPOLBAPEX1ALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108431996-A Composite air electrode and its relative manufacturing process 法国电力公司 2018-08-21 CN disclosed
CN-101253158-B Process for synthesis of aryloxy diaminopyrimidines HOFFMANN LA ROCHE 2013-07-10 CN disclosed
CN-101253158-A Process for synthesis of aryloxy diaminopyrimidines HOFFMANN LA ROCHE (CH) 2008-08-27 CN disclosed
CN-1028521-C Therapeutic agents BOOTS CO PLC (GB) 1995-05-24 CN disclosed
CN-1072173-A Therapeutical agent BOOTS CO PLC (GB) 1993-05-19 CN disclosed