SCHEMBL8939637

SCHEMBL8939637

CC(=O)Oc1ccc(C(c2ccc(OC(C)=O)cc2)c2ccccc2S(=O)(=O)NC2CCCCCCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 3/20 0.43
GAA P10253 2/20 0.43
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
GLA P06280 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ABCB11 O95342 1/20 0.41
ESR1 P03372 1/20 0.41
CYP3A4 P08684 1/20 0.41
ADRA2A P08913 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
PDE4A P27815 1/20 0.41
ADRA1A P35348 1/20 0.41
OPRK1 P41145 1/20 0.41
STAT6 P42226 1/20 0.41
SLC6A3 Q01959 1/20 0.41

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
SCHEMBL8939608 1.00 ALDH1A1 (0.44) ALDH1A1MAPTL3MBTL1LMNAGAA
SCHEMBL8939658 1.00 ALDH1A1 (0.44) ALDH1A1MAPTL3MBTL1LMNAGAA
SCHEMBL8939645 0.83 KMT2A (0.55) ALDH1A1LMNAKMT2AMEN1CYP3A4
SCHEMBL8939654 0.83 ALDH1A1 (0.51) ALDH1A1MAPTL3MBTL1LMNAGAA
SCHEMBL8939701 0.83 ALDH1A1 (0.51) ALDH1A1MAPTL3MBTL1LMNAGAA
SCHEMBL8939610 0.83 ALDH1A1 (0.51) ALDH1A1MAPTL3MBTL1LMNAGAA
SCHEMBL9019620 0.82 KDM4E (0.40) ALDH1A1MAPTLMNAGAAKMT2A
SCHEMBL8939597 0.82 LMNA (0.46) ALDH1A1MAPTLMNAGAAKMT2A
SCHEMBL8939603 0.76 TSHR (0.48) ALDH1A1MAPTLMNAGAAKMT2A
SCHEMBL8939673 0.76 LMNA (0.50) ALDH1A1MAPTLMNAGAAKMT2A

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
EP-0626369-B1 BENZENESULFONAMIDE DERIVATIVE KYOWA HAKKO KOGYO KK (JP) 1996-09-18 EP disclosed
US-5523464-A BONE DISORDERS KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-06-04 US disclosed
EP-0626369-A1 BENZENESULFONAMIDE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-11-30 EP disclosed