SCHEMBL9206507

SCHEMBL9206507

O=C(O)Cc1nn(Cc2cc3c(Cl)cccc3s2)c(=O)c2cccnc12

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 20/20 0.77

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
SCHEMBL9870061 0.93 AKR1B1 (0.77) AKR1B1
SCHEMBL10431004 0.85 AKR1B1 (0.57) AKR1B1
SCHEMBL9203840 0.81 AKR1B1 (0.56) AKR1B1
SCHEMBL9209333 0.78 KMT2A (0.58) AKR1B1
SCHEMBL9870643 0.78 AKR1B1 (0.52) AKR1B1
SCHEMBL9870468 0.74 AKR1B1 (0.50) AKR1B1
SCHEMBL9202242 0.72 AKR1B1 (0.79) AKR1B1
SCHEMBL11192362 0.71 AKR1B1 (0.58) AKR1B1
SCHEMBL9204262 0.70 AKR1B1 (1.00) AKR1B1
SCHEMBL9209897 0.70 AKR1B1 (0.85) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0401981-B1 Pyridazinone deriratives PFIZER (US) 1995-04-26 EP disclosed
US-4996204-A Antidiabetic agents PFIZER INC. (US) 1991-02-26 US disclosed
EP-0401981-A1 Pyridazinone deriratives PFIZER INC. (US) 1990-12-12 EP disclosed