SCHEMBL7733974

SCHEMBL7733974

CCCCOc1c(NC(C)=O)cc(CCC(=O)O)cc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FFAR1 O14842 11/20 0.41
FFAR4 Q5NUL3 8/20 0.41
SOAT1 P35610 2/20 0.40
RXRA P19793 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
AKR1B1 P15121 1/20 0.39
KDM4E B2RXH2 1/20 0.39
APOBEC3A P31941 1/20 0.39
GFER P55789 1/20 0.39
HDAC1 Q13547 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39

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
SCHEMBL7735232 0.95 THRA (0.41) THRATHRBGABRA1GABRB2L3MBTL1
SCHEMBL7725078 0.89 GABRA1 (0.40) GABRA1GABRB2SOAT1HDAC8
SCHEMBL7734873 0.85 THRA (0.46) THRATHRBLMNAL3MBTL1FFAR1
SCHEMBL7735387 0.81 THRA (0.41) THRATHRBFFAR1FFAR4SOAT1
SCHEMBL7734115 0.81 THRA (0.54) THRATHRBFFAR1FFAR4KDM4E
SCHEMBL7734916 0.80 NR3C1 (0.44) THRATHRBFFAR4KDM4E
SCHEMBL7734876 0.78 THRA (0.47) THRATHRBLMNAL3MBTL1FFAR1
SCHEMBL7735380 0.77 PTPN1 (0.44) THRATHRBHDAC8KDM4E
SCHEMBL7734923 0.77 THRA (0.43) THRATHRBFFAR1FFAR4KDM4E
SCHEMBL7725105 0.76 FFAR4 (0.46) THRATHRBLMNAFFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6376546-B1 ANTIALLERGENS ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-04-23 US claimed
EP-1024130-A1 BIPHENYL-5-ALKANOIC ACID DERIVATIVES AND USE THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-08-02 EP claimed
US-6376546-B1 ANTIALLERGENS ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-04-23 US disclosed
EP-1024130-A1 BIPHENYL-5-ALKANOIC ACID DERIVATIVES AND USE THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-08-02 EP disclosed