SCHEMBL29981228

SCHEMBL29981228

O=S(=O)(c1ccc(NCc2ccc(F)cc2Cl)c2cn[nH]c12)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 5/20 0.43
▸ TDO2 P48775 5/20 0.43
▸ P2RX7 Q99572 4/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ EPAS1 Q99814 2/20 0.39
▸ ARNT P27540 1/20 0.39
▸ ALOX15 P16050 4/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ AKT1 P31749 2/20 0.36
▸ AHR P35869 1/20 0.35

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
SCHEMBL23478340 1.00 IDO1 (0.43) IDO1TDO2P2RX7ALDH1A1SMN1; SMN2
SCHEMBL29980738 0.90 PLK4 (0.41) IDO1TDO2EPAS1KDM4EAKT1
SCHEMBL23478370 0.90 PLK4 (0.41) IDO1TDO2EPAS1KDM4EAKT1
SCHEMBL23478324 0.88 HDAC3 (0.42) IDO1TDO2P2RX7EPAS1ARNT
SCHEMBL23478343 0.83 IDO1 (0.39) IDO1TDO2EPAS1
SCHEMBL23478799 0.81 EPAS1 (0.36) IDO1TDO2EPAS1
SCHEMBL23461416 0.81 KDM4E (0.40) IDO1TDO2ALDH1A1EPAS1KDM4E
SCHEMBL23478156 0.78 LMNA (0.41) IDO1TDO2EPAS1AKT1
SCHEMBL23478762 0.74 EPAS1 (0.41) EPAS1
SCHEMBL29780231 0.74 EPAS1 (0.41) EPAS1

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
EP-4069212-A1 INHIBITORS OF HIF-2ALPHA Arcus Biosciences, Inc. (US) 2022-10-12 — — EP disclosed
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