SCHEMBL23856091

SCHEMBL23856091

C[C@@H](C(=O)O)S(=O)(=O)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPSR1 Q6W5P4 1/20 0.33
F2 P00734 2/20 0.32
PRSS1 P07477 2/20 0.32
PRSS2 P07478 2/20 0.32
PRSS3 P35030 2/20 0.32
CXCR2 P25025 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
SLC7A5 Q01650 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA7 P43166 1/20 0.30
CA13 Q8N1Q1 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP7 P09237 1/20 0.30

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
SCHEMBL4643469 1.00 TP53 (0.36) TP53ALDH1A1L3MBTL1NPSR1F2
SCHEMBL4643474 1.00 TP53 (0.36) TP53ALDH1A1L3MBTL1NPSR1F2
SCHEMBL10382347 0.79 TP53 (0.36) TP53ALDH1A1CA1CA2SLC7A5
Trifluoromethanesulfonic Acid SCHEMBL2169403 0.74 ALDH1A1 (0.46) TP53ALDH1A1L3MBTL1CXCR2CA1
Trifluoromethanesulfonic Acid SCHEMBL17318205 0.74 ALDH1A1 (0.46) TP53ALDH1A1L3MBTL1CXCR2CA1
SCHEMBL1148997 0.74 CA1 (0.39) CA1CA2CA7CA13
SCHEMBL23829601 0.72
SCHEMBL18681875 0.72 CA1 (0.33) CA1CA2CA7CA13
SCHEMBL7501293 0.72 ALDH1A1 (0.34) ALDH1A1L3MBTL1CA1CA2
SCHEMBL7496903 0.72 ALDH1A1 (0.34) ALDH1A1L3MBTL1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236129-B2 IL-17A binding peptides and medical uses thereof DOMPE' FARMACEUTICI S.P.A. (IT) 2022-02-01 US disclosed
US-20210300969-A1 IL-17A BINDING PEPTIDES AND MEDICAL USES THEREOF DOMPE' FARMACEUTICI S.P.A. (IT) 2021-09-30 US disclosed