SCHEMBL11567445

SCHEMBL11567445

CCCCCCCCCCc1ccc(S(=O)(=O)Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
PPARA Q07869 1/20 0.52
KCNH2 Q12809 5/20 0.52
LMNA P02545 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
TSHR P16473 1/20 0.52
CYP2C19 P33261 1/20 0.52
HTT P42858 1/20 0.52
HIF1A Q16665 1/20 0.52
CA2 P00918 2/20 0.51
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
FUT7 Q11130 1/20 0.46
ALPL P05186 1/20 0.46
ENPP1 P22413 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
STS P08842 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
SCHEMBL10180587 0.86 ENPP1 (0.59) KCNH2LMNACYP2D6CYP2C9TSHR
SCHEMBL27641648 0.84 CA2 (0.53) PPARAKCNH2CA2FUT7ALPL
SCHEMBL10180729 0.84 TDP1 (0.53) TDP1CA2ENPP1SMN1; SMN2STS
SCHEMBL17993333 0.81 ENPP1 (0.60) KCNH2LMNACYP2D6CYP2C9TSHR
SCHEMBL11106388 0.80 CA2 (0.55) LMNATSHRHTTCA2ALPL
SCHEMBL3621448 0.80 CA2 (0.54) TDP1LMNATSHRHTTCA2
SCHEMBL27289794 0.79 CA2 (0.60) KCNH2LMNACYP2D6CYP2C9TSHR
SCHEMBL5427923 0.79 CA2 (0.51) PPARALMNAHIF1ACA2MEN1
SCHEMBL4062463 0.79 THRB (0.54) LMNAHIF1ACA2MEN1KMT2A
SCHEMBL11654904 0.79 THRB (0.54) LMNAHIF1ACA2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0001495-A1 Peroxygen bleaching and compositions therefor FMC Corporation (US) 1979-04-18 EP disclosed
US-4128490-A BLEACHES FMC CORPORATION (US) 1978-12-05 US disclosed