SCHEMBL11781069

SCHEMBL11781069

CCCCCc1ccc(NS(N)(=O)=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.62
HPGD P15428 1/20 0.59
CA1 P00915 7/20 0.57
CA12 O43570 3/20 0.57
CA9 Q16790 3/20 0.57
SMN1; SMN2 Q16637 1/20 0.54
FFAR1 O14842 1/20 0.54
FFAR4 Q5NUL3 1/20 0.54
LMNA P02545 1/20 0.51
RECQL P46063 1/20 0.51
HTR2A P28223 1/20 0.50
KDM4E B2RXH2 1/20 0.50
ACLY P53396 1/20 0.50
SPHK1 Q9NYA1 2/20 0.48
THRA P10827 2/20 0.48
THRB P10828 2/20 0.48

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
Methane SCHEMBL10645268 0.87 HPGD (0.54) CA2HPGDCA1CA12CA9
Methane SCHEMBL10647539 0.86 KCNH2 (0.57) CA2HPGDCA1CA12CA9
Methane SCHEMBL10642438 0.85 HPGD (0.55) CA2HPGDCA1CA12CA9
Methane SCHEMBL10645459 0.83 KCNH2 (0.53) CA2HPGDCA1CA12CA9
SCHEMBL16976564 0.83 KDM4E (0.65) CA2HPGDCA1CA12CA9
SCHEMBL7151939 0.81 FFAR1 (0.78) CA2HPGDFFAR1FFAR4HTR2A
SCHEMBL14381415 0.81 HPGD (0.58) CA2HPGDCA1CA12CA9
SCHEMBL27446397 0.81 HPGD (0.58) CA2HPGDCA1CA12CA9
Methane SCHEMBL10645237 0.80 KCNH2 (0.51) CA2HPGDCA1CA12CA9
SCHEMBL1645898 0.80 HPGD (0.61) CA2HPGDCA1CA12CA9

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
US-4044151-A Sulfamidophenethanolamine therapeutic process MEAD JOHNSON & COMPANY (US) 1977-08-23 US disclosed