SCHEMBL7969812

SCHEMBL7969812

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

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 10/20 0.62
HTR2C P28335 3/20 0.54
HTR2B P41595 3/20 0.54
KDM1A O60341 6/20 0.43
MAOB P27338 3/20 0.43
KCNH2 Q12809 2/20 0.43
RCOR1 Q9UKL0 2/20 0.43
KDM1B Q8NB78 1/20 0.43
MAOA P21397 1/20 0.39
SLC6A2 P23975 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
RORC P51449 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
SCHEMBL7969809 1.00 ALOX5 (0.62) ALOX5HTR2CHTR2BKDM1AMAOB
SCHEMBL9384912 0.98 ALOX5 (0.60) ALOX5HTR2CHTR2BKDM1AMAOB
SCHEMBL9384910 0.98 ALOX5 (0.60) ALOX5HTR2CHTR2BKDM1AMAOB
SCHEMBL9380910 0.85 HTR2C (0.51) ALOX5HTR2CHTR2BKDM1AMAOB
SCHEMBL7971059 0.85 ALOX5 (0.62) ALOX5HTR2CHTR2BHTR2A
SCHEMBL9381237 0.85 ALOX5 (0.62) ALOX5HTR2CHTR2BSLC6A2HTR2A
SCHEMBL7971054 0.85 ALOX5 (0.62) ALOX5HTR2CHTR2BHTR2A
SCHEMBL9381625 0.85 HTR2C (0.50) ALOX5HTR2CHTR2BKDM1AMAOB
SCHEMBL9381234 0.85 ALOX5 (0.62) ALOX5HTR2CHTR2BSLC6A2HTR2A
SCHEMBL7969804 0.85 ALOX5 (0.62) ALOX5HTR2CHTR2BKDM1ASLC6A2

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