SCHEMBL9382003

SCHEMBL9382003

NC(=O)N(O)CC1CC1c1ccc(-c2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.62
KDM1A O60341 4/20 0.46
MAOB P27338 3/20 0.46
HTR2C P28335 7/20 0.42
HTR2B P41595 6/20 0.42
HTR2A P28223 4/20 0.42
GPR88 Q9GZN0 2/20 0.42
FFAR1 O14842 1/20 0.40

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
SCHEMBL9382006 1.00 ALOX5 (0.62) ALOX5KDM1AMAOBHTR2CHTR2B
SCHEMBL7959746 0.91 ALOX5 (0.71) ALOX5KDM1AMAOBHTR2CHTR2B
SCHEMBL7971315 0.91 ALOX5 (0.71) ALOX5KDM1AMAOBHTR2CHTR2B
SCHEMBL7959749 0.91 ALOX5 (0.71) ALOX5KDM1AMAOBHTR2CHTR2B
SCHEMBL9381731 0.85 ALOX5 (0.80) ALOX5KDM1A
SCHEMBL9381737 0.85 ALOX5 (0.80) ALOX5KDM1A
SCHEMBL7971059 0.82 ALOX5 (0.62) ALOX5HTR2CHTR2BHTR2A
SCHEMBL9381234 0.82 ALOX5 (0.62) ALOX5HTR2CHTR2BHTR2AFFAR1
SCHEMBL7969812 0.82 ALOX5 (0.62) ALOX5KDM1AMAOBHTR2CHTR2B
SCHEMBL9381237 0.82 ALOX5 (0.62) ALOX5HTR2CHTR2BHTR2AFFAR1

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 6 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
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