SCHEMBL25802435

SCHEMBL25802435

O=S(=O)(Nc1ccc(I)c(Cl)c1)C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.49
CA2 P00918 8/20 0.47
PTPN11 Q06124 1/20 0.47
EPHX2 P34913 1/20 0.46
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PTGS1 P23219 2/20 0.44
PTGS2 P35354 2/20 0.44
CA1 P00915 4/20 0.43
HSPD1 P10809 1/20 0.42
HSPE1 P61604 1/20 0.42
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41

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
SCHEMBL1530252 0.77 HPGD (0.58) CA2EPHX2MAPK1SMN1; SMN2CA1
SCHEMBL3528482 0.76 ACLY (0.54) PTPN1CA2PTPN11EPHX2MAPK1
SCHEMBL13602140 0.75 MAPK1 (0.55) PTPN1CA2PTPN11EPHX2MAPK1
SCHEMBL7524156 0.74 PTPN1 (0.63) PTPN1CA2PTPN11MAPK1SMN1; SMN2
SCHEMBL25802961 0.74 PTPN1 (0.63) PTPN1CA2PTPN11MAPK1SMN1; SMN2
SCHEMBL6001019 0.74 PTGS1 (0.64) PTPN1CA2PTPN11EPHX2SMN1; SMN2
SCHEMBL13689726 0.74 MAPK1 (0.50) PTPN1CA2PTPN11EPHX2MAPK1
SCHEMBL3528475 0.73 POLB (0.55) PTPN1CA2PTPN11EPHX2MAPK1
SCHEMBL13719527 0.73 EPHX2 (0.55) PTPN1CA2PTPN11EPHX2MAPK1
SCHEMBL5250781 0.72 CA2 (0.61) PTPN1CA2PTPN11MAPK1SMN1; SMN2

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-2023119910-A1 RADIATION-SENSITIVE COMPOSITION, RESIST PATTERN FORMATION METHOD, ACID GENERATOR, AND COMPOUND JSR株式会社 2023-06-29 WO disclosed