SCHEMBL4937511

SCHEMBL4937511

CCCCCCCCCc1cccc2c(S(=O)(=O)O)cccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.47
MEN1 O00255 1/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
TTR P02766 1/20 0.46
BID P55957 3/20 0.46
MCL1 Q07820 3/20 0.46
PPARA Q07869 3/20 0.46
BCL2L1 Q07817 2/20 0.46
BAK1 Q16611 2/20 0.46
KAT8 Q9H7Z6 2/20 0.46
PPARG P37231 2/20 0.46
SAE1 Q9UBE0 2/20 0.46
EP300 Q09472 1/20 0.46
KAT2A Q92830 1/20 0.46
KAT2B Q92831 1/20 0.46

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
SCHEMBL29198075 1.00 CYP1A2 (0.47) CYP1A2MEN1TP53CYP3A4TSHR
SCHEMBL28124349 0.94 TTR (0.49) CYP1A2MEN1TP53CYP3A4TSHR
SCHEMBL28380744 0.91 LIPG (0.45) CYP1A2MEN1TP53CYP3A4TSHR
SCHEMBL16341746 0.91 LIPG (0.45) CYP1A2MEN1TP53CYP3A4TSHR
SCHEMBL29371301 0.91 LIPG (0.45) CYP1A2MEN1TP53CYP3A4TSHR
SCHEMBL11987818 0.86 CYP1A2 (0.43) CYP1A2MEN1TP53CYP3A4TSHR
SCHEMBL11514241 0.85 MEN1 (0.42) CYP1A2MEN1TP53CYP3A4TSHR
SCHEMBL11026000 0.85 BID (0.43) CYP1A2MEN1TP53CYP3A4TSHR
SCHEMBL3467124 0.85 MEN1 (0.42) CYP1A2MEN1TP53CYP3A4TSHR
SCHEMBL31235608 0.85 MEN1 (0.42) CYP1A2MEN1TP53CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8241482-B2 Process for the recovery of acids NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2012-08-14 US disclosed
US-20080047838-A1 Process for the Recovery of Acids NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2008-02-28 US disclosed
EP-1825027-A2 PROCESS FOR THE RECOVERY OF ACIDS Nederlandse Organisatie voor Toegepast-Natuuurwetenschappelijk Onderzoek TNO (NL) 2007-08-29 EP disclosed
WO-2006054893-A2 PROCESS FOR THE RECOVERY OF ACIDS NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2006-05-26 WO disclosed