SCHEMBL7755707

SCHEMBL7755707

CCc1c(-c2nc3c(F)c(F)cc(F)c3s2)c2cc(Cl)ccc2n1CC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 18/20 0.55
AKR1A1 P14550 17/20 0.55

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
SCHEMBL7755683 0.89 AKR1A1 (0.58) AKR1B1AKR1A1
SCHEMBL6140102 0.82 AKR1B1 (0.56) AKR1B1AKR1A1
SCHEMBL7951912 0.80 AKR1A1 (0.60) AKR1B1AKR1A1
SCHEMBL7754413 0.79 AKR1A1 (0.59) AKR1B1AKR1A1
SCHEMBL2098560 0.77 AKR1B1 (0.58) AKR1B1AKR1A1
SCHEMBL2098715 0.77 AKR1B1 (0.70) AKR1B1AKR1A1
Water SCHEMBL5501664 0.76 AKR1B1 (0.69) AKR1B1AKR1A1
SCHEMBL7517303 0.76 AKR1B1 (0.61) AKR1B1AKR1A1
SCHEMBL2101752 0.76 AKR1B1 (0.59) AKR1B1AKR1A1
SCHEMBL7751532 0.74 AKR1B1 (0.58) AKR1B1AKR1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001051489-A2 METHODS FOR LOWERING URIC ACID LEVELS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2001-07-19 WO claimed