SCHEMBL7328223

SCHEMBL7328223

O=C(O)CC(=Cc1cccc2ccccc12)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
CYP2C19 P33261 2/20 0.47
TSHR P16473 1/20 0.47
ALDH1A1 P00352 4/20 0.47
HPGD P15428 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
GAA P10253 2/20 0.47
MAPT P10636 2/20 0.47
CRHBP P24387 1/20 0.47
HTT P42858 1/20 0.47
CRHR2 Q13324 1/20 0.47
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
TDP1 Q9NUW8 2/20 0.45
RECQL P46063 1/20 0.42
AKR1B1 P15121 2/20 0.42
SMPD2 O60906 2/20 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
SCHEMBL7328215 1.00 KDM4E (0.51) KDM4ECYP2C19TSHRALDH1A1HPGD
SCHEMBL7275461 0.86 KDM4E (0.50) KDM4ECYP2C19ALDH1A1HPGDMEN1
SCHEMBL7275466 0.86 KDM4E (0.50) KDM4ECYP2C19ALDH1A1HPGDMEN1
SCHEMBL5698294 0.85 KDM4E (0.52) KDM4ECYP2C19ALDH1A1HPGDMEN1
SCHEMBL3964497 0.85 KDM4E (0.47) KDM4ECYP2C19ALDH1A1HPGDMEN1
SCHEMBL10477791 0.85 KDM4E (0.50) KDM4ECYP2C19ALDH1A1HPGDMEN1
SCHEMBL3964492 0.85 KDM4E (0.47) KDM4ECYP2C19ALDH1A1HPGDMEN1
SCHEMBL10477792 0.85 KDM4E (0.50) KDM4ECYP2C19ALDH1A1HPGDMEN1
SCHEMBL563351 0.84 KDM4E (0.51) KDM4ECYP2C19ALDH1A1HPGDMEN1
SCHEMBL8865007 0.84 KDM4E (0.55) KDM4ECYP2C19ALDH1A1HPGDMEN1

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2157243-A None JP disclosed
EP-0470702-B1 An optically active morpholino oxobutyric acid hydroxy binaphthalene derivative and its preparation TAKASAGO PERFUMERY CO LTD (JP) 1995-09-27 EP disclosed
US-5106970-A OPTICALLY ACTIVE 4-MORPHOLINO-2-(1-NAPHTHYLMETHYL)-4-OXOBUTYRIC ACID 2'-HYDROXY-1,1'BINAPHTHALEN-2-YL TAKASAGO INTERNATIONAL CORPORATION (JP) 1992-04-21 US disclosed
US-5104869-A Renin inhibitors AMERICAN CYANAMID COMPANY (US) 1992-04-14 US disclosed
EP-0470702-A1 An optically active morpholino oxobutyric acid hydroxy binaphthalene derivative and its preparation Takasago International Corporation (JP) 1992-02-12 EP disclosed
EP-0427939-A2 Renin inhibitors AMERICAN CYANAMID COMPANY (US) 1991-05-22 EP disclosed
EP-0396065-A1 Novel amino acid derivatives possessing renin-inhibitory activities Japan Tobacco Inc. (JP) 1990-11-07 EP disclosed
JP-H02157243-A PRODUCTION OF OPTICALLY ACTIVE (R)-2-(1-NAPHTHYLMETHYL)-SUCCINIC ACID KISSEI PHARMACEUT CO LTD 1990-06-18 JP disclosed
US-4863904-A Dipeptides as renin inhibitors KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-09-05 US disclosed
US-4857650-A Novel renin inhibitory amino acid derivatives KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-08-15 US disclosed
US-4853463-A Amino acid derivatives KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-08-01 US disclosed
US-4841067-A RENIN INHIBITORS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-06-20 US disclosed
US-4711958-A HYPOTENSIVE AGENTS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1987-12-08 US disclosed
EP-0244083-A2 Amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1987-11-04 EP disclosed
US-4656269-A RENIN INHIBITORY EFFECT WHEN ADMINISTERING ORALLY; HYPOTENSIVE AGENTS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1987-04-07 US disclosed
EP-0216539-A2 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1987-04-01 EP disclosed
EP-0206807-A2 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1986-12-30 EP disclosed
EP-0200406-A2 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1986-11-05 EP disclosed
EP-0190891-A2 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1986-08-13 EP disclosed
EP-0181110-A2 Histidine derivatives as renin inhibitors Kissei Pharmaceutical Co. Ltd. (JP) 1986-05-14 EP disclosed