SCHEMBL9490502

SCHEMBL9490502

COc1ccc2c(C)c(Cl)ccc2c1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B10 O60218 1/20 0.39
AKR1A1 P14550 1/20 0.39
AKR1B1 P15121 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 1/20 0.38
RORC P51449 1/20 0.36
NOTUM Q6P988 2/20 0.35
MAPT P10636 5/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
ALOX12 P18054 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 2/20 0.34

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
SCHEMBL9491139 0.83 AKR1B10 (0.40) AKR1B10AKR1A1AKR1B1ALDH1A1HPGD
SCHEMBL9488948 0.80 IDO1 (0.41) AKR1B10AKR1A1AKR1B1ALDH1A1HPGD
SCHEMBL9491074 0.80 AKR1B10 (0.39) AKR1B10AKR1A1AKR1B1ALDH1A1HPGD
SCHEMBL9490629 0.78 AKR1B10 (0.41) AKR1B10AKR1A1AKR1B1ALDH1A1HPGD
SCHEMBL9490571 0.78 AKR1B10 (0.41) AKR1B10AKR1A1AKR1B1RORCNOTUM
SCHEMBL9489560 0.77 ALDH1A1 (0.47) AKR1B10AKR1A1AKR1B1ALDH1A1HPGD
SCHEMBL12805454 0.75 HTR2A (0.42) ALDH1A1HPGDNOTUMMAPTCYP2C9
SCHEMBL9491059 0.75 AKR1B10 (0.42) AKR1B10AKR1A1AKR1B1ALDH1A1HPGD
SCHEMBL9489666 0.75 AKR1B10 (0.48) AKR1B10AKR1A1AKR1B1ALDH1A1HPGD
SCHEMBL9489273 0.74 ALDH1A1 (0.41) AKR1B10AKR1A1AKR1B1ALDH1A1HPGD

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-0322256-A1 N-acyl-N-naphthoylglycines as aldose reductase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1989-06-28 EP disclosed
EP-0322255-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