SCHEMBL8639324

SCHEMBL8639324

CCN1CCC(C(N)=O)CC1Oc1ccc(Cc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 15/20 0.54
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
CYP2C19 P33261 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 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
SCHEMBL8635992 0.91 LTA4H (0.54) LTA4HNPC1RAB9ACYP2C19SMN1; SMN2
SCHEMBL8641938 0.91 LTA4H (0.52) LTA4HNPC1RAB9ASMN1; SMN2
SCHEMBL8637399 0.88 LTA4H (0.47) LTA4HNPC1RAB9ASMN1; SMN2
SCHEMBL8639583 0.86 LTA4H (0.46) LTA4HNPC1RAB9ACYP2C19SMN1; SMN2
SCHEMBL8644364 0.82 LTA4H (0.48) LTA4H
SCHEMBL8641861 0.82 LTA4H (0.47) LTA4HNPC1RAB9A
SCHEMBL8642217 0.82 LTA4H (0.42) LTA4H
SCHEMBL8641258 0.80 LTA4H (0.47) LTA4HNPC1RAB9A
SCHEMBL8635904 0.79 LTA4H (0.41) LTA4HCYP2C19
SCHEMBL8644367 0.78 LTA4H (0.42) 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 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