SCHEMBL7969804

SCHEMBL7969804

NC(=O)N(O)C[C@@H]1C[C@H]1c1ccc(F)cc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.62
HTR2C P28335 3/20 0.54
SLC6A2 P23975 2/20 0.54
HTR2A P28223 2/20 0.54
SLC6A4 P31645 2/20 0.54
HTR2B P41595 2/20 0.54
SLC6A3 Q01959 2/20 0.54
SLC9A1 P19634 1/20 0.46
KDM1A O60341 2/20 0.43
DRD2 P14416 6/20 0.39
DRD4 P21917 4/20 0.39
DRD1 P21728 1/20 0.38
DRD3 P35462 1/20 0.38

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
SCHEMBL7969802 1.00 ALOX5 (0.62) ALOX5HTR2CSLC6A2HTR2ASLC6A4
SCHEMBL7971054 0.85 ALOX5 (0.62) ALOX5HTR2CHTR2AHTR2BSLC9A1
SCHEMBL7969809 0.85 ALOX5 (0.62) ALOX5HTR2CSLC6A2HTR2ASLC6A4
SCHEMBL9381234 0.85 ALOX5 (0.62) ALOX5HTR2CSLC6A2HTR2ASLC6A4
SCHEMBL7971059 0.85 ALOX5 (0.62) ALOX5HTR2CHTR2AHTR2BSLC9A1
SCHEMBL9381237 0.85 ALOX5 (0.62) ALOX5HTR2CSLC6A2HTR2ASLC6A4
SCHEMBL7969812 0.85 ALOX5 (0.62) ALOX5HTR2CSLC6A2HTR2ASLC6A4
SCHEMBL7959746 0.84 ALOX5 (0.71) ALOX5HTR2CHTR2AHTR2BSLC9A1
SCHEMBL7971315 0.84 ALOX5 (0.71) ALOX5HTR2CHTR2AHTR2BSLC9A1
SCHEMBL7959749 0.84 ALOX5 (0.71) ALOX5HTR2CHTR2AHTR2BSLC9A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0436199-B1 Cyclopropyl derivative lipoxygenase inhibitors ABBOTT LAB (US) 1994-08-03 EP claimed
EP-0436199-A1 Cyclopropyl derivative lipoxygenase inhibitors ABBOTT LABORATORIES (US) 1991-07-10 EP claimed
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-0436199-B1 Cyclopropyl derivative lipoxygenase inhibitors ABBOTT LAB (US) 1994-08-03 EP disclosed
US-5120752-A N-(1-(20(3-pyridyloxy)phenyl)cyclopropyl) alkyl-N-hydroxyurea compounds, antiinflammatory agents ABBOTT LABORATORIES (US) 1992-06-09 US disclosed
US-5037853-A Antiinflammatory agents ABBOTT LABORATORIES (US) 1991-08-06 US disclosed
EP-0436199-A1 Cyclopropyl derivative lipoxygenase inhibitors ABBOTT LABORATORIES (US) 1991-07-10 EP disclosed