SCHEMBL25845154

SCHEMBL25845154

CC(I)C(=O)Oc1ccc(C(=O)OC(CS(=O)(=O)O)C(F)(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.37
MAPT P10636 3/20 0.34
ALDH1A1 P00352 1/20 0.34
STS P08842 3/20 0.33
GAA P10253 1/20 0.32
PRSS1 P07477 4/20 0.32
TMPRSS15 P98073 4/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
ACHE P22303 1/20 0.32
ACR P10323 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
TSHR P16473 1/20 0.31

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
SCHEMBL18891086 0.87 ELANE (0.36) ELANEMAPTALDH1A1STSGAA
SCHEMBL18775684 0.85 MAPT (0.41) ELANEMAPTACR
SCHEMBL25845200 0.83 ELANE (0.33) ELANEMAPTALDH1A1PRSS1CA12
SCHEMBL19880553 0.83 ELANE (0.32) ELANEMAPTALDH1A1STSACR
SCHEMBL25844842 0.83 NOTUM (0.34) ALDH1A1GAAPRSS1TMPRSS15
SCHEMBL18775779 0.83 CA1 (0.45) ELANEMAPTGAACA1CA2
SCHEMBL25844847 0.82 KMT2A (0.32) MAPTALDH1A1PRSS1ACR
SCHEMBL20009240 0.82 PARP10 (0.44) MAPTALDH1A1GAA
SCHEMBL18775760 0.81 ELANE (0.44) ELANEMAPTALDH1A1STSPRSS1
SCHEMBL25845044 0.81 MEN1 (0.31) PRSS1ACR

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
US-11709426-B2 Resist composition and pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-07-25 US disclosed