SCHEMBL9019622

SCHEMBL9019622

O=S(=O)(NC1C2CC3CC(C2)CC1C3)c1ccccc1C(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.40
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
POLB P06746 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
EPHX2 P34913 3/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32

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
SCHEMBL9019620 0.84 KDM4E (0.40) HSD11B1KMT2AALDH1A1GAATDP1
SCHEMBL9019623 0.78 ALDH1A1 (0.42) HSD11B1KMT2AALDH1A1GAATDP1
SCHEMBL8939654 0.78 ALDH1A1 (0.51) KMT2AALDH1A1GAATDP1
SCHEMBL8939701 0.78 ALDH1A1 (0.51) KMT2AALDH1A1GAATDP1
SCHEMBL8939610 0.78 ALDH1A1 (0.51) KMT2AALDH1A1GAATDP1
SCHEMBL9019625 0.75 KMT2A (0.36) HSD11B1KMT2AALDH1A1GAATDP1
SCHEMBL9522240 0.75 KMT2A (0.54) HSD11B1KMT2AALDH1A1GAATDP1
SCHEMBL8939599 0.72 ALDH1A1 (0.45) KMT2AALDH1A1GAATDP1
Hydrochloric Acid SCHEMBL9522102 0.72 POLB (0.41) KMT2AALDH1A1GAATDP1POLB
SCHEMBL11351755 0.71 GAA (0.53) KMT2AALDH1A1GAATDP1

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-0626369-B1 BENZENESULFONAMIDE DERIVATIVE KYOWA HAKKO KOGYO KK (JP) 1996-09-18 EP disclosed
EP-0626369-A1 BENZENESULFONAMIDE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-11-30 EP disclosed