SCHEMBL16355207

SCHEMBL16355207

COCCOCCNC(=O)CCOCCSCc1cccc(C(=O)Nc2ccc(N3CCCCC3)cc2-c2cc(C(=O)NCc3cccc(C(F)(F)F)c3)ccn2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC34A2 O95436 1/20 0.65
BRAF P15056 5/20 0.38
RAF1 P04049 2/20 0.38
ROCK2 O75116 3/20 0.38
ROCK1 Q13464 3/20 0.38
GPR52 Q9Y2T5 1/20 0.37
NPSR1 Q6W5P4 3/20 0.35
KIT P10721 1/20 0.34
FLT3 P36888 1/20 0.34
TEK Q02763 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
PHGDH O43175 1/20 0.34
HSP90AA1 P07900 1/20 0.34

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
SCHEMBL15432751 1.00 SLC34A2 (0.65) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL15432752 0.95 SLC34A2 (0.63) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL16355215 0.95 SLC34A2 (0.70) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL15432766 0.95 SLC34A2 (0.70) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL16355209 0.95 SLC34A2 (0.62) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL46436 0.93 SLC34A2 (0.59) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL46437 0.92 SLC34A2 (0.60) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL15432918 0.91 SLC34A2 (0.53) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL19580025 0.91 SLC34A2 (0.75) SLC34A2BRAFRAF1ROCK2ROCK1
SCHEMBL15432736 0.91 SLC34A2 (0.75) 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
US-8916569-B2 Compounds and methods for inhibiting phosphate transport ARDELYX, INC. (US) 2014-12-23 US disclosed