SCHEMBL6025271

SCHEMBL6025271

CCCCc1ccc(S(=O)(=O)ON=C(C(=O)O)c2ccc(C)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.46
ENPP1 P22413 1/20 0.45
HAO1 Q9UJM8 1/20 0.44
RARB P10826 2/20 0.43
ALDH1A1 P00352 2/20 0.42
CA2 P00918 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PLK1 P53350 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
PLA2G1B P04054 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PLK3 Q9H4B4 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL6025267 1.00 CNR2 (0.46) CNR2ENPP1HAO1RARBALDH1A1
SCHEMBL6025854 0.89 ENPP1 (0.43) CNR2ENPP1HAO1RARBALDH1A1
SCHEMBL6025345 0.89 ENPP1 (0.43) CNR2ENPP1HAO1RARBALDH1A1
SCHEMBL6025057 0.88 KMT2A (0.45) ENPP1ALDH1A1SMN1; SMN2TDP1HPGD
SCHEMBL6025055 0.88 KMT2A (0.45) ENPP1ALDH1A1SMN1; SMN2TDP1HPGD
SCHEMBL6025244 0.86 STAT3 (0.44) ALDH1A1CA2SMN1; SMN2TDP1HPGD
SCHEMBL6025245 0.86 STAT3 (0.44) ALDH1A1CA2SMN1; SMN2TDP1HPGD
SCHEMBL6024585 0.81 RECQL (0.47) ALDH1A1TDP1HPGD
SCHEMBL6024583 0.81 RECQL (0.47) ALDH1A1TDP1HPGD
SCHEMBL6025438 0.80 KMT2A (0.49) ALDH1A1SMN1; SMN2TDP1

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
EP-1163553-B1 OXIME DERIVATIVES AND THE USE THEREOF AS PHOTOINITIATORS CIBA SC HOLDING AG (CH) 2006-06-14 EP claimed