SCHEMBL7325136

SCHEMBL7325136

CCOC(=O)C(CC)C(=O)OCc1cccc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.49
▸ ALDH1A1 P00352 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ EPHX1 P07099 1/20 0.46
▸ SLC1A3 P43003 1/20 0.46
▸ SLC1A2 P43004 1/20 0.46
▸ SLC1A1 P43005 1/20 0.46
▸ CDC25B P30305 2/20 0.46
▸ TACR1 P25103 1/20 0.46
▸ ATM Q13315 1/20 0.45
▸ CTNNB1 P35222 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ APOBEC3A P31941 1/20 0.44
▸ APOBEC3G Q9HC16 1/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PARP10 Q53GL7 1/20 0.44

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
SCHEMBL6719502 0.84 CTNNB1 (0.59) KMT2AALDH1A1HPGDCDC25BTACR1
SCHEMBL12419177 0.82 EPHX1 (0.48) KMT2AALDH1A1EPHX1SLC1A3SLC1A2
SCHEMBL8083878 0.82 SLC1A3 (0.52) KMT2AALDH1A1EPHX1SLC1A3SLC1A2
SCHEMBL7322093 0.81 CTNNB1 (0.60) KMT2AALDH1A1HPGDSLC1A3SLC1A2
SCHEMBL18671842 0.81 EPHX1 (0.47) KMT2AALDH1A1HPGDEPHX1SLC1A3
SCHEMBL1045002 0.80 ALDH1A1 (0.50) KMT2AALDH1A1HPGDCDC25BKDM4E
SCHEMBL6589138 0.80 CTNNB1 (0.55) KMT2AALDH1A1HPGDCDC25BTACR1
SCHEMBL10966205 0.79 EPHX2 (0.47) KMT2AALDH1A1HPGDMEN1MAPT
SCHEMBL27320801 0.79 EPHX2 (0.47) KMT2AALDH1A1HPGDTDP1MAPT
SCHEMBL13821887 0.78 EPHX2 (0.51) KMT2AALDH1A1HPGDCDC25BTACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1046525-C Compounds containing a fused bicyclic ring and processes therefor BRISTOL MYERS SQUIBB CO (US) 1999-11-17 — — CN disclosed
CN-1099392-A Compounds containing a fused bicyclic ring and processes therefor BRISTOL MYERS SQIBB COMPANY (US) 1995-03-01 — — CN disclosed
US-5262436-A Administering; enzyme inhibitor SCHERING CORPORATION (US) 1993-11-16 — — US disclosed
EP-0566157-A1 Neutral metalloendopeptidase inhibitors in the treatment of hypertension SCHERING CORPORATION (US) 1993-10-20 — — EP disclosed
US-5061710-A Atrial natriuretic factors SCHERING CORPORATION (US) 1991-10-29 — — US disclosed
US-4929641-A DIURETICS, ANGIOTENSIN CONVERTING ENZYMES SCHERING CORPORATION (US) 1990-05-29 — — US disclosed
US-4801609-A Mercapto-acylamino acid antihypertensives SCHERING CORPORATION (US) 1989-01-31 — — US disclosed
EP-0254032-A2 Neutral metalloendopeptidase inhibitors in the treatment of hypertension SCHERING CORPORATION (US) 1988-01-27 — — EP disclosed
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