SCHEMBL7972996

SCHEMBL7972996

NC(=O)N(O)CC1CCC(c2ccc(F)cc2)C1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 12/20 0.51
SLC9A1 P19634 1/20 0.40
CYP2C9 P11712 1/20 0.39
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
TP53 P04637 1/20 0.35
PARP10 Q53GL7 1/20 0.35
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL7970872 0.90 ALOX5 (0.47) ALOX5SLC9A1TP53LMNAPOLB
SCHEMBL7970869 0.90 ALOX5 (0.47) ALOX5SLC9A1TP53LMNAPOLB
SCHEMBL7959765 0.75 ALOX5 (0.53) ALOX5SLC9A1DPP4DPP8DPP9
SCHEMBL7971261 0.75 ALOX5 (0.47) ALOX5SLC9A1TP53POLBALDH1A1
SCHEMBL7969804 0.75 ALOX5 (0.62) ALOX5SLC9A1
SCHEMBL7971120 0.75 ALOX5 (0.53) ALOX5SLC9A1DPP4DPP8DPP9
SCHEMBL7971258 0.75 ALOX5 (0.47) ALOX5SLC9A1TP53POLBALDH1A1
SCHEMBL7959762 0.75 ALOX5 (0.53) ALOX5SLC9A1DPP4DPP8DPP9
SCHEMBL7971122 0.75 ALOX5 (0.53) ALOX5SLC9A1DPP4DPP8DPP9
SCHEMBL7969802 0.75 ALOX5 (0.62) ALOX5SLC9A1

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 2 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