SCHEMBL7734829

SCHEMBL7734829

COC(=O)CCCc1ccc(OCCCCCl)c(-c2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.48
MAPT P10636 1/20 0.45
C5AR1 P21730 1/20 0.44
LTB4R Q15722 1/20 0.44
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
KDM4E B2RXH2 5/20 0.43
GAA P10253 1/20 0.43
PDE4A P27815 2/20 0.42
PDE4B Q07343 2/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42
PLAAT3 P53816 1/20 0.42
PLAAT5 Q96KN8 1/20 0.42
PLAAT2 Q9NWW9 1/20 0.42
PLAAT4 Q9UL19 1/20 0.42
HPGD P15428 1/20 0.42
ALDH1A1 P00352 1/20 0.41
SLC6A9 P48067 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL7735854 0.91 PTPN1 (0.48) PTPN1MAPTC5AR1LTB4RTHRA
SCHEMBL7737650 0.91 THRA (0.53) PTPN1C5AR1LTB4RTHRATHRB
SCHEMBL7737515 0.90 THRA (0.49) PTPN1MAPTC5AR1LTB4RTHRA
SCHEMBL7735769 0.89 PTPN1 (0.49) PTPN1MAPTC5AR1LTB4RTHRA
SCHEMBL7734076 0.88 CYP1A2 (0.48) LTB4RTHRATHRBSLC6A9PTGDR2
SCHEMBL7735887 0.87 PTPN1 (0.47) PTPN1MAPTC5AR1LTB4RTHRA
SCHEMBL7724915 0.87 PTPN1 (0.48) PTPN1MAPTC5AR1THRATHRB
SCHEMBL7734111 0.87 PTPN1 (0.49) PTPN1MAPTC5AR1LTB4RTHRA
SCHEMBL27403097 0.86 PTPN1 (0.56) PTPN1MAPTC5AR1LTB4RTHRA
SCHEMBL7725102 0.86 PTPN1 (0.48) PTPN1MAPTC5AR1LTB4RTHRA

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
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