SCHEMBL8736604

SCHEMBL8736604

O=Cc1ccc(OCC(=O)O)c(Cc2cccc3ccccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
HPGD P15428 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
BCL2L1 Q07817 1/20 0.48
PLA2G2A P14555 1/20 0.48
ELANE P08246 4/20 0.46
F2 P00734 1/20 0.46
PLA2G1B P04054 2/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.44
CTSD P07339 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CTSG P08311 1/20 0.42
P2RX3 P56373 1/20 0.42
PTPN7 P35236 1/20 0.42
PDE1A P54750 1/20 0.41
PDE1B Q01064 1/20 0.41
PDE1C Q14123 1/20 0.41

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
SCHEMBL6798515 0.81 NPC1 (0.54) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL8733973 0.77 TDP1 (0.51) TDP1KDM4EALDH1A1HPGDBCL2L1
SCHEMBL5650340 0.76 ALDH1A1 (0.57) KDM4EALDH1A1PTGDR2L3MBTL1
SCHEMBL5554103 0.76 BCL2L1 (0.67) TDP1KDM4EALDH1A1HPGDBCL2L1
SCHEMBL5559504 0.75 BCL2L1 (0.74) TDP1KDM4EALDH1A1HPGDBCL2L1
SCHEMBL7906854 0.75 NPC1 (0.60) KDM4EALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL5559075 0.74 BCL2L1 (0.58) TDP1KDM4EALDH1A1HPGDBCL2L1
SCHEMBL5554775 0.74 BCL2L1 (0.58) TDP1KDM4EALDH1A1HPGDBCL2L1
SCHEMBL14787928 0.73 ALDH1A1 (0.63) TDP1KDM4EALDH1A1NPC1RAB9A
SCHEMBL5554198 0.73 BCL2L1 (0.56) TDP1KDM4EALDH1A1HPGDBCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1200106-A Phenoxy acetic acids as aldose reductase inhibitors and antihyperglycemic agents AMERICAN HOME PROD (US) 1998-11-25 CN disclosed
EP-0847379-A1 PHENOXY ACETIC ACIDS AS ALDOSE REDUCTASE INHIBITORS AND ANTIHYPERGLYCEMIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1998-06-17 EP disclosed
EP-0847379-A1 PHENOXY ACETIC ACIDS AS ALDOSE REDUCTASE INHIBITORS AND ANTIHYPERGLYCEMIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1998-06-17 EP disclosed
US-5677342-A ANTIDIABETIC AGENT AMERICAN HOME PRODUCTS CORPORATION (US) 1997-10-14 US disclosed
US-5677342-A ANTIDIABETIC AGENT AMERICAN HOME PRODUCTS CORPORATION (US) 1997-10-14 US disclosed
WO-1997008126-A1 PHENOXY ACETIC ACIDS AS ALDOSE REDUCTASE INHIBITORS AND ANTIHYPERGLYCEMIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-03-06 WO disclosed
WO-1997008126-A1 PHENOXY ACETIC ACIDS AS ALDOSE REDUCTASE INHIBITORS AND ANTIHYPERGLYCEMIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-03-06 WO disclosed