SCHEMBL8939649

SCHEMBL8939649

O=S(=O)(c1ccccc1C(c1ccc(O)cc1)c1ccc(O)cc1)N1CCCCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 5/20 0.46
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MCL1 Q07820 1/20 0.43
KDM4E B2RXH2 1/20 0.41
LMNA P02545 2/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
USP2 O75604 1/20 0.40
POLB P06746 1/20 0.40
GFER P55789 1/20 0.40

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
SCHEMBL8939653 0.82 HSD11B1 (0.47) TSHRKMT2ASMN1; SMN2ALDH1A1GAA
SCHEMBL8939603 0.81 TSHR (0.48) TSHRCYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL8939707 0.78 ALDH1A1 (0.60) TSHRKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL24498674 0.76 TSHR (0.68) TSHRCYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL9962277 0.76 TSHR (0.68) TSHRCYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL11351755 0.76 GAA (0.53) TSHRKMT2ASMN1; SMN2ALDH1A1GAA
SCHEMBL14456672 0.74 TSHR (0.65) TSHRCYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL9900047 0.74 TSHR (0.59) TSHRCYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL15844498 0.72 TSHR (0.62) TSHRCYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL3344622 0.72 TSHR (0.57) TSHRCYP3A4CYP2C9CYP2C19KMT2A

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