SCHEMBL4603074

SCHEMBL4603074

Cc1ccc(C(=O)O)cc1-c1ccc(C(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.62
GRIA1 P42261 1/20 0.62
GRIA2 P42262 1/20 0.62
GRIA3 P42263 1/20 0.62
GRIA4 P48058 1/20 0.62
RXRA P19793 6/20 0.55
RXRB P28702 3/20 0.55
RARA P10276 1/20 0.54
RARB P10826 3/20 0.51
RARG P13631 1/20 0.51
MAPK14 Q16539 3/20 0.50
ALDH1A1 P00352 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TSHR P16473 2/20 0.49
TP53 P04637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
NR1H4 Q96RI1 1/20 0.46
MAP4K4 O95819 1/20 0.46
RXRG P48443 1/20 0.46
HSPB1 P04792 1/20 0.46

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
SCHEMBL2744390 0.92 GRIK1 (0.59) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL2744011 0.91 GRIK1 (0.57) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL2744081 0.90 GRIK1 (0.56) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL7112789 0.89 GRIK1 (0.56) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL2745136 0.89 BCL2L1 (0.58) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL10110947 0.89 ALDH1A1 (0.57) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL4602270 0.88 GRIK1 (0.55) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL16749653 0.88 RXRA (0.59) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL6563011 0.87 HSD17B1 (0.56) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL2342676 0.86 PTGS2 (0.51) GRIK1GRIA1GRIA2GRIA3GRIA4

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-1940786-A1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C Arrow Therapeutics Limited (GB) 2008-07-09 EP disclosed
WO-2007031791-A1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C ARROW THERAPEUTICS LIMITED (GB) 2007-03-22 WO disclosed