SCHEMBL30856884

SCHEMBL30856884

CC1Cc2c(Oc3cc(F)cc(C#N)c3)ccc(S(C)(=O)=O)c2C1=O

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 20/20 0.66
VEGFA P15692 3/20 0.63
CYP2C9 P11712 1/20 0.59
ARNT P27540 1/20 0.59
CYP2C19 P33261 1/20 0.59

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
SCHEMBL16555888 1.00 EPAS1 (0.66) EPAS1VEGFACYP2C9ARNTCYP2C19
SCHEMBL16555528 0.90 EPAS1 (0.66) EPAS1VEGFACYP2C9ARNTCYP2C19
SCHEMBL21005536 0.83 EPAS1 (0.49) EPAS1VEGFACYP2C9ARNTCYP2C19
SCHEMBL16555738 0.82 EPAS1 (0.68) EPAS1VEGFACYP2C9ARNTCYP2C19
SCHEMBL30605959 0.82 EPAS1 (0.68) EPAS1VEGFACYP2C9ARNTCYP2C19
SCHEMBL16556057 0.81 EPAS1 (0.66) EPAS1VEGFACYP2C9ARNTCYP2C19
SCHEMBL16555409 0.80 EPAS1 (0.64) EPAS1VEGFA
SCHEMBL16555475 0.80 EPAS1 (0.68) EPAS1VEGFA
SCHEMBL24317169 0.80 EPAS1 (0.70) EPAS1VEGFACYP2C9ARNTCYP2C19
SCHEMBL19870988 0.80 EPAS1 (0.80) EPAS1VEGFACYP2C9ARNTCYP2C19

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-RE49948-E1 Aryl ethers and uses thereof PELOTON THERAPEUTICS, INC. (US) 2024-04-30 US disclosed