SCHEMBL46623

SCHEMBL46623

CCc1cccc(C(=O)Nc2ccc(N3CCCCC3)cc2C(=O)N/N=C/c2ccc(Cl)c(C(F)(F)F)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC34A2 O95436 11/20 0.49
SLC34A1 Q06495 1/20 0.43
SLC34A3 Q8N130 1/20 0.43
SLC20A1 Q8WUM9 1/20 0.43
ADCYAP1R1 P41586 3/20 0.39
HDAC1 Q13547 1/20 0.39
ALDH1A1 P00352 1/20 0.38
RAF1 P04049 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
SCHEMBL45091 0.93 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1ADCYAP1R1
SCHEMBL40226 0.93 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1ADCYAP1R1
SCHEMBL15421175 0.93 SLC34A2 (0.48) SLC34A2SLC34A1SLC34A3SLC20A1ADCYAP1R1
SCHEMBL40444 0.93 SLC34A2 (0.48) SLC34A2SLC34A1SLC34A3SLC20A1ADCYAP1R1
SCHEMBL15444463 0.93 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1ADCYAP1R1
SCHEMBL10274308 0.93 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1ADCYAP1R1
SCHEMBL40710 0.93 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1ADCYAP1R1
SCHEMBL47010 0.91 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1ADCYAP1R1
SCHEMBL265714 0.91 SLC34A2 (0.52) SLC34A2SLC34A1SLC34A3SLC20A1ADCYAP1R1
SCHEMBL274037 0.91 SLC34A2 (0.52) SLC34A2SLC34A1SLC34A3SLC20A1ADCYAP1R1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2591354-B1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX INC (US) 2016-09-07 EP disclosed
WO-2012006475-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2012-01-12 WO disclosed