SCHEMBL11215706

SCHEMBL11215706

CCOC(=O)C(=O)CCCCCCC1=CC(O)CC1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.42
TBXAS1 P24557 1/20 0.33
ALDH1A1 P00352 5/20 0.32
MAPT P10636 3/20 0.32
HPGD P15428 3/20 0.32
LMNA P02545 2/20 0.32
HSP90AA1 P07900 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
POLB P06746 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
KYAT1 Q16773 1/20 0.30
USP2 O75604 1/20 0.30
ALOX15 P16050 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
HSD17B10 Q99714 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL11810537 0.87 CYP4F2 (0.44) TBXAS1ALDH1A1MAPTCYP4F2CYP4A11
SCHEMBL10753712 0.87 CYP4F2 (0.44) TBXAS1ALDH1A1MAPTCYP4F2CYP4A11
SCHEMBL9496265 0.87 CYP4F2 (0.44) TBXAS1ALDH1A1MAPTCYP4F2CYP4A11
SCHEMBL11808317 0.87 CYP4F2 (0.44) TBXAS1ALDH1A1MAPTCYP4F2CYP4A11
SCHEMBL9498988 0.87 CYP4F2 (0.44) TBXAS1ALDH1A1MAPTCYP4F2CYP4A11
SCHEMBL11808352 0.81 CYP1A2 (0.40) TBXAS1ALDH1A1MAPTHPGDCYP4F2
SCHEMBL2677059 0.79 HPGD (0.41) ALDH1A1HPGDLMNATDP1GAA
SCHEMBL2720980 0.79 HPGD (0.41) ALDH1A1HPGDLMNATDP1GAA
SCHEMBL11787951 0.79 HPGD (0.41) ALDH1A1HPGDLMNATDP1GAA
SCHEMBL4967427 0.79 HPGD (0.41) ALDH1A1HPGDLMNATDP1GAA

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
US-4338252-A BRONCHODILATORS, HYPOTENSIVE, ANTIULCER AMERICAN CYANAMID COMPANY (US) 1982-07-06 US disclosed
US-4283550-A BRONCHODILATOR AGENTS, HYPOTENSIVE AGENTS, ANTIULCER AGENTS AMERICAN CYANAMID (US) 1981-08-11 US disclosed
US-4267361-A HYPOTENSIVE, ANTIULCER, AND BRONCHODILATOR AGENTS AMERICAN CYANAMID COMPANY (US) 1981-05-12 US disclosed
US-4260805-A BRONCHODILATOR AGENTS, HYPOTENSIVE AGENTS, ANTIULCER AGENTS AMERICAN CYANAMID COMPANY (US) 1981-04-07 US disclosed
US-4254275-A BRONCHODILATORS, ANTIULCER, HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1981-03-03 US disclosed
US-4254278-A BRONCHODILATORS, ANTIULCER, HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1981-03-03 US disclosed
US-4250321-A BRONCHODILATORS, HYPOTENSIVE AGENTS, ANTIULCER AGENTS AMERICAN CYANAMID COMPANY (US) 1981-02-10 US disclosed
US-4250323-A BRONCHODILATORS, HYPOTENSIVE AGENTS, ANTIULCER AGENTS AMERICAN CYANAMID COMPANY (US) 1981-02-10 US disclosed