SCHEMBL8637337

SCHEMBL8637337

CCCOC(=O)C1CCN(Oc2ccc(Cc3ccccc3)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 9/20 0.60
PKM P14618 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CCR8 P51685 1/20 0.45
MAPT P10636 1/20 0.44
TSHR P16473 2/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 1/20 0.44
EGFR P00533 1/20 0.44

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
SCHEMBL8640062 0.87 LTA4H (0.51) LTA4HTSHRNPC1ALDH1A1RAB9A
SCHEMBL22533378 0.78 ABL1 (0.62) LTA4HCCR8MAPTTSHRALDH1A1
SCHEMBL8635900 0.76 LTA4H (0.52) LTA4HPKMMAPTTSHRNPC1
SCHEMBL8642317 0.76 MEN1 (0.60) LTA4HPKMNPSR1MAPTNPC1
SCHEMBL1900326 0.75 LTA4H (1.00) LTA4HEGFR
SCHEMBL8641935 0.73 LTA4H (0.61) LTA4HCCR8EGFR
SCHEMBL8637340 0.72 LTA4H (0.63) LTA4HCCR8EGFR
SCHEMBL8201553 0.71 LTA4H (0.67) LTA4HPKMNPSR1CCR8MAPT
SCHEMBL8046203 0.71 LTA4H (0.67) LTA4HPKMNPSR1MAPTTSHR
SCHEMBL8639296 0.70 ALDH1A1 (0.56) PKMCCR8MAPTTSHRNPC1

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
US-5723492-A LTA4 hydrolase inhibitor pharmaceutical compositions and methods of use G.D. SEARLE & CO. (US) 1998-03-03 US disclosed
US-5719306-A ANTIINFLAMMATORY AGENTS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed