SCHEMBL7725111

SCHEMBL7725111

CCCCOc1ccc(CCC(=O)OC)cc1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.56
▸ THRA P10827 1/20 0.50
▸ THRB P10828 1/20 0.50
▸ AKR1C3 P42330 1/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ C5AR1 P21730 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ RXRA P19793 1/20 0.44
▸ PPARG P37231 3/20 0.43
▸ PPARA Q07869 1/20 0.43
▸ TLR7 Q9NYK1 1/20 0.43
▸ SLC6A9 P48067 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PTGES O14684 1/20 0.43
▸ ALOX5 P09917 1/20 0.43
▸ PTGDR2 Q9Y5Y4 1/20 0.42

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
SCHEMBL7734899 0.96 PTPN1 (0.55) PTPN1THRATHRBAKR1C3KDM4E
SCHEMBL7737515 0.94 THRA (0.49) PTPN1THRATHRBAKR1C3KDM4E
SCHEMBL7737650 0.91 THRA (0.53) PTPN1THRATHRBKDM4EC5AR1
SCHEMBL27403097 0.91 PTPN1 (0.56) PTPN1THRATHRBKDM4EC5AR1
SCHEMBL7734788 0.89 RXRA (0.53) THRATHRBKDM4ERXRAPPARG
SCHEMBL3894136 0.88 CCNC (0.51) PTPN1AKR1C3KDM4EHDAC1HDAC2
SCHEMBL27428215 0.87 PTPN1 (0.53) PTPN1THRATHRBAKR1C3KDM4E
SCHEMBL7724925 0.85 THRA (0.52) THRATHRBKDM4EALDH1A1SMN1; SMN2
SCHEMBL7734086 0.85 THRA (0.57) PTPN1THRATHRBKDM4ERXRA
SCHEMBL7735347 0.85 PTPN1 (0.55) PTPN1KDM4EALDH1A1SMN1; SMN2PTGDR2

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
CN-1103332-C Biphenyl-5-alkanoic acid derivs. and use thereof ASAHI CHEMICAL IND (JP) 2003-03-19 — — CN disclosed
US-6376546-B1 ANTIALLERGENS ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-04-23 — — US disclosed
CN-1276778-A Biphenyl-5-alkanoic acid derivs. and use thereof ASAHI CHEMICAL IND (JP) 2000-12-13 — — CN disclosed
EP-1024130-A1 BIPHENYL-5-ALKANOIC ACID DERIVATIVES AND USE THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-08-02 — — EP disclosed
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