SCHEMBL30697126

SCHEMBL30697126

O=S(=O)(c1ccccc1Cl)c1ccccc1Cl

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.59
AKR1B1 P15121 1/20 0.53
GAA P10253 2/20 0.50
TSHR P16473 2/20 0.47
LMNA P02545 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ALDH1A1 P00352 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NFE2L2 Q16236 7/20 0.46
PGR P06401 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL2123876 1.00 HSD11B1 (0.59) HSD11B1AKR1B1GAATSHRLMNA
SCHEMBL248010 1.00 HSD11B1 (0.59) HSD11B1AKR1B1GAATSHRLMNA
SCHEMBL3409083 0.91 HSD11B1 (0.52) HSD11B1AKR1B1GAATSHRLMNA
SCHEMBL9475449 0.87 HSD11B1 (0.75) HSD11B1AKR1B1ALDH1A1KMT2A
SCHEMBL8674824 0.87 HSD11B1 (0.50) HSD11B1AKR1B1GAATSHRHSD17B10
SCHEMBL8406360 0.87 HSD11B1 (0.49) HSD11B1AKR1B1GAATSHRHSD17B10
SCHEMBL9417287 0.87 GAA (0.75) HSD11B1AKR1B1GAATSHRHSD17B10
SCHEMBL516500 0.85 HSD11B1 (0.67) HSD11B1AKR1B1GAATSHRHSD17B10
SCHEMBL11340710 0.84 HSD11B1 (0.50) HSD11B1AKR1B1GAATSHRLMNA
SCHEMBL13241574 0.83 CA1 (0.55) HSD11B1AKR1B1MEN1KMT2A

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
CN-117186406-A Polysulfone resin and polymerization method thereof 广东优巨先进新材料股份有限公司 2023-12-08 CN disclosed