SCHEMBL8939613

SCHEMBL8939613

COc1ccccc1N1CCN(S(=O)(=O)c2ccccc2C(c2ccc(OC(C)=O)cc2)c2ccc(OC(C)=O)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
ALDH1A1 P00352 3/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
POLB P06746 2/20 0.53
TP53 P04637 1/20 0.53
GAA P10253 4/20 0.51
GFER P55789 2/20 0.51
LMNA P02545 4/20 0.50
USP2 O75604 2/20 0.50
TSHR P16473 2/20 0.50
GLA P06280 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MAPT P10636 3/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 2/20 0.48
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL8939721 0.89 HSD11B1 (0.44) KMT2AALDH1A1SMN1; SMN2POLBTP53
SCHEMBL8939707 0.87 ALDH1A1 (0.60) KMT2AALDH1A1SMN1; SMN2POLBTP53
SCHEMBL8939603 0.82 TSHR (0.48) KMT2AALDH1A1SMN1; SMN2POLBGAA
SCHEMBL9125133 0.80 ALDH1A1 (0.58) KMT2AALDH1A1SMN1; SMN2POLBGAA
SCHEMBL8939638 0.77 MMP2 (0.49) KMT2AALDH1A1SMN1; SMN2LMNAUSP2
SCHEMBL2950399 0.73 SMN1; SMN2 (0.74) KMT2AALDH1A1SMN1; SMN2POLBTP53
SCHEMBL8939653 0.73 HSD11B1 (0.47) KMT2AALDH1A1SMN1; SMN2TP53GAA
SCHEMBL8939673 0.72 LMNA (0.50) KMT2AALDH1A1SMN1; SMN2POLBTP53
SCHEMBL9128159 0.69 ALDH1A1 (0.58) KMT2AALDH1A1SMN1; SMN2POLBLMNA
SCHEMBL8939684 0.68 LMNA (0.47) KMT2AALDH1A1SMN1; SMN2TP53GAA

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