SCHEMBL13766337

SCHEMBL13766337

CCc1ccc(OCC2CCCCN2)cc1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 18/20 0.70

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
SCHEMBL13809309 0.95 LTA4H (0.69) LTA4H
SCHEMBL16313564 0.84 LTA4H (0.68) LTA4H
SCHEMBL7332735 0.82 LTA4H (1.00) LTA4H
SCHEMBL13809077 0.82 LTA4H (1.00) LTA4H
Hydrochloric Acid SCHEMBL4307735 0.81 LTA4H (0.97) LTA4H
SCHEMBL27996072 0.81 LTA4H (1.00) LTA4H
SCHEMBL13809289 0.81 LTA4H (1.00) LTA4H
SCHEMBL13809288 0.81 LTA4H (1.00) LTA4H
Hydrochloric Acid SCHEMBL4307742 0.81 LTA4H (0.97) LTA4H
SCHEMBL3166997 0.81 LTA4H (0.88) LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7557110-B2 MAPKAP-K2; inflammatory disease, autoimmune disease, destructive bone disorder, cancer and/or tumour growth; 5-[(trans-4-aminocyclohexyl)amino]-3-fluoro-6-methyl(pyrazolo[1,5-a]pyri- midin-7-yl)}(4-iodophenyl)amine TEIJIN PHARMA LIMITED (JP) 2009-07-07 US disclosed