SCHEMBL7734098

SCHEMBL7734098

CCCCOc1c(N)cc(CCCC(=O)OC)cc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 1/20 0.40
PTPN1 P18031 2/20 0.40
HDAC8 Q9BY41 2/20 0.39
CNR2 P34972 3/20 0.39
CNR1 P21554 1/20 0.39
PPARG P37231 2/20 0.39
PPARA Q07869 1/20 0.39
LTA4H P09960 1/20 0.38
KDM4E B2RXH2 1/20 0.38
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
TLR7 Q9NYK1 1/20 0.37

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
SCHEMBL7737564 0.94 PTPN1 (0.45) LTB4RPTPN1HDAC8CNR2CNR1
SCHEMBL7735407 0.87 TRPV1 (0.43) CNR2CNR1PPARGPPARA
SCHEMBL7725078 0.84 GABRA1 (0.40) LTB4RPTPN1HDAC8CNR2CNR1
SCHEMBL7735710 0.83 ALDH1A1 (0.45) LTB4RPTPN1CNR2PPARG
SCHEMBL7734892 0.83 HDAC8 (0.39) LTB4RPTPN1HDAC8CNR2CNR1
SCHEMBL7735362 0.83 PTPN1 (0.39) LTB4RPTPN1HDAC8CNR2CNR1
SCHEMBL27607975 0.81 CCNC (0.48) PTPN1CNR2CNR1PPARGPPARA
SCHEMBL7737515 0.81 THRA (0.49) LTB4RPTPN1PPARGPPARALTA4H
SCHEMBL27402110 0.80 LTB4R (0.43) LTB4RHDAC8PPARGPPARA
SCHEMBL3889870 0.79 CCNC (0.48) PTPN1

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