SCHEMBL10012928

SCHEMBL10012928

COc1ccc(C(=O)C[S+](C)C)c2ccccc12.O=S(=O)(NS(=O)(=O)C(F)(F)F)C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.51
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
STAT6 P42226 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PLK1 P53350 1/20 0.46
FABP4 P15090 11/20 0.42
CDC25B P30305 1/20 0.41
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40

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
Trifluoromethanesulfonic Acid SCHEMBL10013055 0.88 HPGDS (0.53) HPGDSALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL10012046 0.86 HPGDS (0.51) HPGDSALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL29936431 0.85 HPGDS (0.68) HPGDSALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL562156 0.85 HPGDS (0.68) HPGDSALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL6117969 0.81 HPGDS (0.47) HPGDSALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL564962 0.77 HPGDS (0.53) HPGDSALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL29878494 0.77 HPGDS (0.53) HPGDSALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL12477866 0.74 HPGDS (0.53) HPGDSALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL10012016 0.73 HPGDS (0.52) HPGDSALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL10013056 0.72 HPGDS (0.53) HPGDSALDH1A1CYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9051452-B2 Polymer compositions for temporary bonding PROMERUS, LLC (US) 2015-06-09 US disclosed
US-8633259-B2 Polymer compositions for temporary bonding PROMERUS, LLC (US) 2014-01-21 US disclosed
US-20120172479-A1 POLYMER COMPOSITIONS FOR TEMPORARY BONDING PROMERUS LLC (US) 2012-07-05 US disclosed