SCHEMBL7725072

SCHEMBL7725072

CN(C)C(=O)COc1ccc(CCCC(=O)O)cc1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 9/20 0.50
ALDH1A1 P00352 3/20 0.48
HSD17B10 Q99714 2/20 0.48
MAPK1 P28482 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
CYP1A2 P05177 2/20 0.45
SLC6A9 P48067 1/20 0.45
PLA2G10 O15496 1/20 0.44
PLA2G2A P14555 1/20 0.44
PTGER1 P34995 1/20 0.44
PTGER4 P35408 1/20 0.44
PTGER3 P43115 1/20 0.44
PTGER2 P43116 1/20 0.44
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
RECQL P46063 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
SCHEMBL7735779 0.90 PTPN1 (0.47) PTGDR2ALDH1A1HSD17B10MAPK1LMNA
SCHEMBL7737523 0.90 ALDH1A1 (0.51) PTGDR2ALDH1A1LMNAMAPTCYP1A2
SCHEMBL7725122 0.88 PTGDR2 (0.60) PTGDR2MAPK1CYP1A2PLA2G10PLA2G2A
SCHEMBL7734112 0.84 PTGDR2 (0.53) PTGDR2MAPK1CYP1A2PLA2G10PLA2G2A
SCHEMBL7725029 0.84 CYP1A2 (0.52) PTGDR2MAPK1CYP1A2SLC6A9PLA2G10
SCHEMBL7724415 0.83 CYP1A2 (0.51) PTGDR2MAPK1LMNACYP1A2SLC6A9
SCHEMBL7724925 0.82 THRA (0.52) PTGDR2ALDH1A1MAPK1CYP1A2SLC6A9
SCHEMBL7733989 0.81 THRA (0.56) PTGDR2CYP1A2SLC6A9PLA2G10PLA2G2A
SCHEMBL7734077 0.81 PPARD (0.47) PTGDR2MAPK1CYP1A2PLA2G10PLA2G2A
SCHEMBL7735866 0.81 CYP1A2 (0.49) PTGDR2MAPK1CYP1A2SLC6A9PLA2G10

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