SCHEMBL9201252

SCHEMBL9201252

O=C(O)Cc1nn(Cc2nc3cc(F)cc(F)c3s2)c(=O)c2cccnc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 20/20 1.00

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
SCHEMBL9872753 0.93 AKR1B1 (0.87) AKR1B1
SCHEMBL1590287 0.88 AKR1B1 (1.00) AKR1B1
SCHEMBL9202242 0.86 AKR1B1 (0.79) AKR1B1
SCHEMBL10430980 0.86 AKR1B1 (0.75) AKR1B1
SCHEMBL9206592 0.82 AKR1B1 (0.70) AKR1B1
SCHEMBL9322386 0.81 AKR1B1 (1.00) AKR1B1
SCHEMBL9195294 0.80 AKR1B1 (1.00) AKR1B1
SCHEMBL9871647 0.79 AKR1B1 (0.79) AKR1B1
SCHEMBL9871499 0.79 AKR1B1 (0.65) AKR1B1
SCHEMBL9204262 0.79 AKR1B1 (1.00) AKR1B1

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
EP-0401981-B1 Pyridazinone deriratives PFIZER (US) 1995-04-26 EP disclosed