SCHEMBL26219802

SCHEMBL26219802

Cc1ccc(S(=O)(=O)NCCOCCOCCOCCOCCO)cc1

nearest known ligand 0.82

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.82
LMNA P02545 2/20 0.60
HPGD P15428 2/20 0.60
HTT P42858 1/20 0.60
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
CA12 O43570 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
ALOX15 P16050 1/20 0.52
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TSHR P16473 1/20 0.48
USP2 O75604 1/20 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
SCHEMBL7776599 0.98 ALDH1A1 (0.84) ALDH1A1LMNAHPGDHTTMEN1
SCHEMBL8048430 0.92 ALDH1A1 (0.96) ALDH1A1LMNAHPGDHTTMEN1
SCHEMBL9066249 0.92 ALDH1A1 (0.96) ALDH1A1LMNAHPGDHTTMEN1
SCHEMBL18894208 0.91 ALDH1A1 (1.00) ALDH1A1LMNAHPGDHTTMEN1
SCHEMBL23476689 0.86 ALDH1A1 (0.59) ALDH1A1LMNAHPGDCA2MAPT
SCHEMBL29316529 0.86 ALDH1A1 (0.84) ALDH1A1LMNAHPGDHTTMEN1
SCHEMBL17281797 0.85 ALDH1A1 (0.82) ALDH1A1LMNAHPGDHTTMEN1
SCHEMBL30325179 0.85 ALDH1A1 (0.58) ALDH1A1LMNAHPGDCA12CA2
SCHEMBL30325135 0.85 ALDH1A1 (0.58) ALDH1A1LMNAHPGDCA12CA2
SCHEMBL19593673 0.85 ALDH1A1 (0.82) ALDH1A1LMNAHPGDHTTMEN1

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-20230287300-A1 SURFACTANT AND DETERGENT COMPOSITION CONOPCO, INC., D/B/A UNILEVER (US) 2023-09-14 US disclosed