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SCHEMBL47010

SCHEMBL47010

CN(C)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 12/20 0.49
▸ SLC34A1 Q06495 1/20 0.40
▸ SLC34A3 Q8N130 1/20 0.40
▸ SLC20A1 Q8WUM9 1/20 0.40
▸ HDAC1 Q13547 1/20 0.37
▸ ADCYAP1R1 P41586 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ RAF1 P04049 1/20 0.36

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
SCHEMBL46623 0.91 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1HDAC1
SCHEMBL40226 0.90 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1HDAC1
SCHEMBL45091 0.90 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1HDAC1
SCHEMBL15421175 0.90 SLC34A2 (0.48) SLC34A2SLC34A1SLC34A3SLC20A1HDAC1
SCHEMBL40444 0.90 SLC34A2 (0.48) SLC34A2SLC34A1SLC34A3SLC20A1HDAC1
SCHEMBL15444463 0.90 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1HDAC1
SCHEMBL40710 0.90 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1HDAC1
SCHEMBL10274308 0.90 SLC34A2 (0.49) SLC34A2SLC34A1SLC34A3SLC20A1HDAC1
SCHEMBL265715 0.89 SLC34A2 (0.52) SLC34A2SLC34A1SLC34A3SLC20A1HDAC1
SCHEMBL274037 0.89 SLC34A2 (0.52) SLC34A2SLC34A1SLC34A3SLC20A1HDAC1

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
WO-2012006475-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2012-01-12 — — WO disclosed