SCHEMBL6025374

SCHEMBL6025374

COc1ccc(C(=NOS(=O)(=O)c2ccc(C)cc2)C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
GAA P10253 2/20 0.50
MAPT P10636 4/20 0.48
TP53 P04637 2/20 0.48
LMNA P02545 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 2/20 0.47
HPGD P15428 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
EGFR P00533 1/20 0.45
EP300 Q09472 1/20 0.45
KAT2A Q92830 1/20 0.45
KAT2B Q92831 1/20 0.45

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
SCHEMBL6025371 1.00 ALDH1A1 (0.50) ALDH1A1GAAMAPTTP53LMNA
SCHEMBL6025244 0.92 STAT3 (0.44) ALDH1A1GAAMAPTLMNACYP2C9
SCHEMBL6025245 0.92 STAT3 (0.44) ALDH1A1GAAMAPTLMNACYP2C9
SCHEMBL6024585 0.86 RECQL (0.47) ALDH1A1MAPTTP53LMNAKMT2A
SCHEMBL6024583 0.86 RECQL (0.47) ALDH1A1MAPTTP53LMNAKMT2A
SCHEMBL6025438 0.85 KMT2A (0.49) ALDH1A1GAAMAPTTP53LMNA
SCHEMBL6025440 0.85 KMT2A (0.49) ALDH1A1GAAMAPTTP53LMNA
SCHEMBL6024701 0.85 ALDH1A1 (0.49) ALDH1A1GAAMAPTTP53LMNA
SCHEMBL6024704 0.85 ALDH1A1 (0.49) ALDH1A1GAAMAPTTP53LMNA
SCHEMBL6024508 0.84 PAX8 (0.52) ALDH1A1GAAMAPTLMNACYP1A2

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