SCHEMBL9656458

SCHEMBL9656458

NC(=O)N(O)C1CCc2cc3ccccc3n21

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
NOTUM Q6P988 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
SCHEMBL9736815 0.90 NOTUM (0.56) ALOX5NOTUM
SCHEMBL9736607 0.68 NOTUM (0.39) NOTUM
SCHEMBL9656449 0.68 ALOX5 (0.37) ALOX5
SCHEMBL30684094 0.67 CYP1A2 (0.40) NOTUM
SCHEMBL28330578 0.65 PLA2G10 (0.47)
SCHEMBL18229909 0.65 NOTUM (0.46) NOTUM
SCHEMBL6168100 0.64 PLA2G10 (0.40)
SCHEMBL21028082 0.63 NR1H2 (0.35) NOTUM
SCHEMBL19067224 0.63 HTR2A (0.42) NOTUM
SCHEMBL21028020 0.63 HTR2A (0.38) NOTUM

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
WO-1992021678-A1 LIPOXYGENASE INHIBITING PYRROLO [1,2a]INDOLE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1992-12-10 WO disclosed
US-5128364-A Antiasthmatic, antiallergic, antiinflammatory and cytoprotective agents MERCK FROSST CANADA, INC. (CA) 1992-07-07 US disclosed