SCHEMBL25901928

SCHEMBL25901928

CCCCOc1ccc(S(=O)(=O)CCCS(C)(=O)=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.59
TSHR P16473 4/20 0.58
CA12 O43570 3/20 0.58
CA1 P00915 3/20 0.58
CA2 P00918 3/20 0.58
CA9 Q16790 3/20 0.58
CA7 P43166 2/20 0.58
MAPK1 P28482 1/20 0.49
RECQL P46063 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
ALDH1A1 P00352 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
LMNA P02545 3/20 0.48
HTT P42858 3/20 0.48
MMP13 P45452 4/20 0.47
MMP8 P22894 2/20 0.47

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
SCHEMBL25314534 0.88 MMP1 (0.47) MMP1TSHRCA12CA1CA2
SCHEMBL25902130 0.85 TDP1 (0.51) MMP1TSHRCA12CA1CA2
SCHEMBL7208418 0.84 MMP1 (0.63) MMP1TSHRCA12CA1CA2
SCHEMBL7207812 0.84 MMP13 (0.69) MMP1TSHRCA12CA1CA2
SCHEMBL15060917 0.83 CA12 (0.70) MMP1TSHRCA12CA1CA2
SCHEMBL5388006 0.82 MMP1 (0.61) MMP1TSHRCA12CA1CA2
SCHEMBL5384277 0.82 MMP1 (0.61) MMP1TSHRCA12CA1CA2
SCHEMBL8798490 0.81 CA12 (0.58) MMP1TSHRCA12CA1CA2
SCHEMBL6743970 0.81 TSHR (0.68) MMP1TSHRCA12CA1CA2
SCHEMBL13527221 0.80 TSHR (0.66) MMP1TSHRCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023141432-A2 APOL1 INHIBITORS AND METHODS OF USE MAZE THERAPEUTICS, INC. (US) 2023-07-27 WO disclosed