SCHEMBL7737523

SCHEMBL7737523

CCN(CC)C(=O)COc1ccc(CCCC(=O)O)cc1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
HPGD P15428 1/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
PTGDR2 Q9Y5Y4 8/20 0.49
APP P05067 1/20 0.48
TSHR P16473 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
CYP1A2 P05177 1/20 0.44
PLA2G10 O15496 1/20 0.43
PLA2G2A P14555 1/20 0.43
PTGER1 P34995 1/20 0.43
PTGER4 P35408 1/20 0.43
PTGER3 P43115 1/20 0.43
PTGER2 P43116 1/20 0.43

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
SCHEMBL7725041 0.90 ALDH1A1 (0.48) ALDH1A1HPGDNPC1RAB9APTGDR2
SCHEMBL7725072 0.90 PTGDR2 (0.50) ALDH1A1HPGDNPC1RAB9APTGDR2
SCHEMBL7725122 0.87 PTGDR2 (0.60) PTGDR2CYP1A2PLA2G10PLA2G2APTGER1
SCHEMBL7724925 0.83 THRA (0.52) ALDH1A1PTGDR2CYP1A2PLA2G10PLA2G2A
SCHEMBL7734112 0.83 PTGDR2 (0.53) PTGDR2CYP1A2PLA2G10PLA2G2APTGER1
SCHEMBL7725029 0.83 CYP1A2 (0.52) PTGDR2CYP1A2PLA2G10PLA2G2APTGER1
SCHEMBL7733989 0.82 THRA (0.56) PTGDR2CYP1A2PLA2G10PLA2G2APTGER1
SCHEMBL7724415 0.82 CYP1A2 (0.51) PTGDR2LMNACYP1A2PLA2G10PLA2G2A
SCHEMBL7734077 0.80 PPARD (0.47) PTGDR2CYP1A2PLA2G10PLA2G2APTGER1
SCHEMBL7735779 0.80 PTPN1 (0.47) ALDH1A1HPGDNPC1RAB9APTGDR2

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