SCHEMBL7969402

SCHEMBL7969402

NC(=O)N(O)C1CC(c2ccccc2)C1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.56
AKR1C3 P42330 1/20 0.43
AKR1C1 Q04828 1/20 0.43
SLC9A1 P19634 1/20 0.39
GRIN2B Q13224 1/20 0.39
BRD4 O60885 3/20 0.39
KDM1A O60341 1/20 0.38
KDM4E B2RXH2 2/20 0.38
MGLL Q99685 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL7969404 1.00 ALOX5 (0.56) ALOX5AKR1C3AKR1C1SLC9A1GRIN2B
SCHEMBL7973050 1.00 ALOX5 (0.56) ALOX5AKR1C3AKR1C1SLC9A1GRIN2B
SCHEMBL7969806 0.90 ALOX5 (0.50) ALOX5AKR1C3AKR1C1BRD4KDM1A
SCHEMBL7959801 0.88 AKR1C3 (0.51) ALOX5AKR1C3AKR1C1SLC9A1KDM4E
SCHEMBL7973212 0.88 AKR1C3 (0.51) ALOX5AKR1C3AKR1C1SLC9A1KDM4E
SCHEMBL7972821 0.88 AKR1C3 (0.51) ALOX5AKR1C3AKR1C1SLC9A1KDM4E
SCHEMBL7973213 0.88 AKR1C3 (0.51) ALOX5AKR1C3AKR1C1SLC9A1KDM4E
SCHEMBL7972824 0.88 AKR1C3 (0.51) ALOX5AKR1C3AKR1C1SLC9A1KDM4E
SCHEMBL7969772 0.87 ALOX5 (0.47) ALOX5AKR1C3AKR1C1KDM4E
SCHEMBL9195806 0.87 ALOX5 (0.47) ALOX5AKR1C3AKR1C1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6291520-B1 INHIBIT THE ENZYME LIPOXYGENASE; TREATMENT OR ALLEVIATION OF INFLAMMATORY DISEASES, ALLERGIC CONDITIONS AND CARDIOVASCULAR DISEASES PFIZER 2001-09-18 US disclosed
EP-0559743-B1 NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE PFIZER (US) 1995-03-08 EP disclosed
EP-0559743-A1 NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE. PFIZER HOSPITAL PROD (US) 1993-09-15 EP disclosed
US-5187192-A Amide derivatives as antiinflammatory or antiallergy agents ABBOTT LABORATORIES (US) 1993-02-16 US disclosed
WO-1992009566-A1 NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE PFIZER INC. (US) 1992-06-11 WO disclosed