SCHEMBL8637359

SCHEMBL8637359

CCCC(N)(CC(=O)N1CCOCC1)Oc1ccc(Cc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 4/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MEN1 O00255 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 1/20 0.42
PKM P14618 1/20 0.41
LTA4H P09960 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CTSL P07711 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
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
SCHEMBL8635978 0.80 LTA4H (0.43) LTA4H
SCHEMBL8644157 0.78 LTA4H (0.39) LTA4H
SCHEMBL8644274 0.71 LTA4H (0.41) LTA4HCYP2C9HTT
SCHEMBL5653626 0.71 KMT2A (0.72) KMT2ASMN1; SMN2MEN1KDM4ENPC1
SCHEMBL1516144 0.68 MAPT (0.82) FKBP1AMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL11117435 0.68 MAPT (0.67) FKBP1AMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL17338907 0.67 HRH3 (0.64) FKBP1AMAPTKMT2ASMN1; SMN2HTT
Hydrochloric Acid SCHEMBL68316 0.67 MAPT (0.79) FKBP1AMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL8644118 0.66 LTA4H (0.39) LTA4H
SCHEMBL7132003 0.66 LTA4H (0.65) FKBP1ARAB9ALTA4HCYP2C9

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