SCHEMBL19580010

SCHEMBL19580010

CC(C)(SCc1cccc(C(=O)Nc2ccc(N3CCCCC3)cc2-c2cc(C(=O)NCc3cccc(C(F)(F)F)c3)ccn2)c1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC34A2 O95436 1/20 0.54
BRAF P15056 5/20 0.42
RAF1 P04049 2/20 0.42
USP2 O75604 1/20 0.39
TLR9 Q9NR96 1/20 0.39
ROCK2 O75116 3/20 0.39
ROCK1 Q13464 2/20 0.39
KDM4E B2RXH2 2/20 0.39
HRH4 Q9H3N8 1/20 0.39
TEK Q02763 1/20 0.38
KDR P35968 1/20 0.38
SRPK2 P78362 1/20 0.38
SRPK1 Q96SB4 1/20 0.38
SRPK3 Q9UPE1 1/20 0.38

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
SCHEMBL6002472 0.91 SLC34A2 (0.55) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL6002461 0.91 SLC34A2 (0.52) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL39722 0.90 SLC34A2 (0.57) SLC34A2BRAFRAF1USP2TLR9
SCHEMBL40075 0.89 SLC34A2 (0.52) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL19579971 0.89 SLC34A2 (0.50) SLC34A2BRAFRAF1USP2TLR9
SCHEMBL39860 0.88 SLC34A2 (0.53) SLC34A2BRAFRAF1USP2TLR9
SCHEMBL45535 0.88 SLC34A2 (0.64) SLC34A2BRAFRAF1USP2TLR9
SCHEMBL19580033 0.88 SLC34A2 (0.51) SLC34A2BRAFRAF1USP2TLR9
SCHEMBL19579940 0.88 SLC34A2 (0.58) SLC34A2BRAFRAF1USP2TLR9
SCHEMBL15432502 0.88 SLC34A2 (0.52) SLC34A2BRAFRAF1ROCK2ROCK1

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-2590656-B1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX INC (US) 2017-11-15 EP claimed