SCHEMBL7972144

SCHEMBL7972144

CCOc1ccc(-c2ccc(C(=O)O)cc2)cc1-c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.63
RXRB P28702 2/20 0.63
EGFR P00533 1/20 0.60
RARB P10826 8/20 0.59
RARG P13631 8/20 0.59
RARA P10276 7/20 0.56
SLC6A9 P48067 1/20 0.55
LTB4R Q15722 1/20 0.53
BCL2 P10415 1/20 0.52
TSHR P16473 1/20 0.52
RXRG P48443 1/20 0.52
POLB P06746 1/20 0.52
CASP6 P55212 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HCRTR1 O43613 1/20 0.52
HCRTR2 O43614 1/20 0.52
MAP4K4 O95819 1/20 0.51

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
SCHEMBL9474035 0.90 TSHR (0.60) RXRARXRBEGFRLTB4RTSHR
SCHEMBL3550156 0.85 RXRA (0.66) RXRARXRBEGFRRXRGHCRTR1
SCHEMBL25125396 0.85 TSHR (0.57) RXRARXRBEGFRRARBRARG
SCHEMBL9473321 0.82 SYK (0.66)
SCHEMBL7505298 0.81 GAA (0.55) RXRARXRBEGFRRARBRARG
SCHEMBL6536373 0.81 TSHR (0.60) RXRARXRBEGFRLTB4RTSHR
SCHEMBL5347979 0.79 MEN1 (0.60) RXRARXRBTSHRRXRGPOLB
SCHEMBL4603368 0.79 PTPN11 (0.59) RXRARXRBSLC6A9LTB4RTSHR
SCHEMBL1721733 0.79 TSHR (0.62) RXRARXRBEGFRRARBTSHR
SCHEMBL2746908 0.78 SRD5A2 (0.53) RXRARXRBEGFRRARBRARG

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-6288092-B1 BIPHENYL PYRIDINES, BENZAMIDES AND PENYLCARBOXY COMPOUNDS USED AS SELECTIVE INHIBITORS OF PHOSPHODIESTERASE 4 ISOENZYME ACTIVITY AND DOWN REGULATORS OR INHIBIT TUMOR NECROSIS FACTOR RELEASE; ANTIHISTAMINES AND ANTIINFLAMMATORY NOVARTIS AG (CH) 2001-09-11 US disclosed