SCHEMBL9489296

SCHEMBL9489296

COc1ccc2c(CO)c(F)ccc2c1C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B10 O60218 1/20 0.43
AKR1A1 P14550 1/20 0.43
AKR1B1 P15121 1/20 0.43
PDE4B Q07343 4/20 0.35
PDE4A P27815 3/20 0.33
PDE4C Q08493 3/20 0.33
PDE4D Q08499 3/20 0.33
PDE5A O76074 2/20 0.33
PDE1A P54750 2/20 0.33
PDE1B Q01064 2/20 0.33
PDE3B Q13370 2/20 0.33
PDE1C Q14123 2/20 0.33
PDE3A Q14432 2/20 0.33
PTGS2 P35354 1/20 0.33
PTPN7 P35236 1/20 0.33
DUSP3 P51452 1/20 0.33
CYP2C9 P11712 2/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL9490571 0.85 AKR1B10 (0.41) AKR1B10AKR1A1AKR1B1PDE4BPDE4A
SCHEMBL9491008 0.85 AKR1B10 (0.41) AKR1B10AKR1A1AKR1B1PDE4BPDE4A
SCHEMBL9489502 0.84 AKR1B10 (0.40) AKR1B10AKR1A1AKR1B1PTPN7DUSP3
SCHEMBL9491139 0.77 AKR1B10 (0.40) AKR1B10AKR1A1AKR1B1PDE4BPDE4A
SCHEMBL18978995 0.76 LMNA (0.39) PDE4BPDE4APDE4CPDE4DPDE5A
SCHEMBL31719480 0.74 ROCK2 (0.38) PDE4BPDE4APDE4CPDE4DPDE5A
SCHEMBL4399022 0.74 ROCK2 (0.38) PDE4BPDE4APDE4CPDE4DPDE5A
SCHEMBL9491116 0.74 AKR1B10 (0.39) AKR1B10AKR1A1AKR1B1ALDH1A1HPGD
SCHEMBL9490146 0.74 AKR1B10 (0.47) AKR1B10AKR1A1AKR1B1PDE4BPDE4A
SCHEMBL1620119 0.73 CYP3A4 (0.41) CYP2C9LMNAMAPK1HTTRAB9A

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
EP-0322256-B1 N-ACYL-N-NAPHTHOYLGLYCINES AS ALDOSE REDUCTASE INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1993-03-24 EP disclosed
EP-0322255-B1 N-ACYL-N-NAPHTHOYLGLYCINES AS ALDOSE REDUCTASE INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1993-03-24 EP disclosed
US-4962224-A TREATMENT OR PREVENTION OF DIABETES AMERICAN HOME PRODUCTS CORPORATION (US) 1990-10-09 US disclosed
WO-1989005793-A1 N-ACYL-N-NAPHTHOYLGLYCINES AS ALDOSE REDUCTASE INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1989-06-29 WO disclosed
EP-0322255-A1 N-acyl-N-naphthoylglycines as aldose reductase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1989-06-28 EP disclosed
EP-0322256-A1 N-acyl-N-naphthoylglycines as aldose reductase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1989-06-28 EP disclosed
US-4820727-A TREATING DIABETIC COMPLICATIONS-VISION DEFECTS, KIDNEY AND NERVOUS SYSTEM DISORDERS AMERICAN HOME PRODUCTS CORPORATION (US) 1989-04-11 US disclosed