SCHEMBL8778753

SCHEMBL8778753

CCC(O)S(=O)(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.50
HSD11B1 P28845 2/20 0.44
LMNA P02545 1/20 0.43
MMP1 P03956 4/20 0.43
MMP13 P45452 4/20 0.43
MMP7 P09237 3/20 0.43
MMP12 P39900 3/20 0.43
ACE P12821 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ATM Q13315 1/20 0.43
TSHR P16473 1/20 0.43
CCR5 P51681 1/20 0.41
HTR6 P50406 1/20 0.41
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
POLB P06746 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39

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
SCHEMBL3917298 0.84 SMN1; SMN2 (0.50) PSIP1HSD11B1MMP1MMP13MMP7
SCHEMBL6094396 0.83 PSIP1 (0.42) PSIP1HSD11B1LMNAMMP1MMP13
SCHEMBL8778760 0.82 GAA (0.46) MMP1MMP13SMN1; SMN2KDM4ECA1
SCHEMBL6095331 0.80 LARS1 (0.47) PSIP1HSD11B1MMP1MMP13MMP7
SCHEMBL4432536 0.79 TSHR (0.43) PSIP1HSD11B1LMNAMMP1MMP13
SCHEMBL27430447 0.79 TSHR (0.43) PSIP1HSD11B1LMNAMMP1MMP13
SCHEMBL28807013 0.79 HSD11B1 (0.43) PSIP1HSD11B1MMP1MMP13MMP7
SCHEMBL13276428 0.78 PSIP1 (0.54) PSIP1HSD11B1MMP1MMP13MMP7
SCHEMBL2443658 0.78 PSIP1 (0.54) PSIP1HSD11B1MMP1MMP13MMP7
SCHEMBL3415944 0.78 ATM (0.43) ATMCA1CA2MMP2L3MBTL1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0602914-B1 Ink compositions for ink jet printing XEROX CORP (US) 1997-11-12 EP claimed
US-5300143-A Water soluble dye, sulfone, and amide or cyclic amine XEROX CORPORATION (US) 1994-04-05 US claimed
CN-116606232-A Novel monofluoroalkyl compounds, preparation method and application thereof 许昌学院 2023-08-18 CN disclosed
CN-106496367-A Catalytic component and its preparation and application for olefinic polymerization 中国石油化工股份有限公司 2017-03-15 CN disclosed
EP-0602914-B1 Ink compositions for ink jet printing XEROX CORP (US) 1997-11-12 EP disclosed
EP-0602914-A1 Ink compositions for ink jet printing XEROX CORPORATION (US) 1994-06-22 EP disclosed
US-5300143-A Water soluble dye, sulfone, and amide or cyclic amine XEROX CORPORATION (US) 1994-04-05 US disclosed