SCHEMBL8938994

SCHEMBL8938994

CCCCOP(Oc1ccc(OC)cc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.41
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
CA4 P22748 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 2/20 0.36
TRPA1 O75762 1/20 0.36
KCNH2 Q12809 2/20 0.35
TP53 P04637 1/20 0.35
PTGS2 P35354 1/20 0.35
NPC1 O15118 1/20 0.35
KIF11 P52732 1/20 0.35

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
SCHEMBL20710739 0.92 LTA4H (0.49) LTA4HDRD2DRD3L3MBTL1TDP1
SCHEMBL8939021 0.85 CA4 (0.43) LTA4HDRD2DRD4DRD3CA4
SCHEMBL2938616 0.83 LTA4H (0.47) LTA4HL3MBTL1HPGDTDP1TP53
SCHEMBL8939002 0.81 CA4 (0.47) LTA4HDRD2DRD4DRD3CA4
SCHEMBL11209432 0.78 LTA4H (0.43) LTA4HL3MBTL1TDP1TP53
SCHEMBL15417421 0.77 CA2 (0.36) LTA4HCA4HPGDTDP1
SCHEMBL2929963 0.76 LTA4H (0.46) LTA4HDRD2DRD3MAPTKCNH2
SCHEMBL2937814 0.76 LTA4H (0.46) LTA4HDRD2DRD3MAPTKCNH2
SCHEMBL21403902 0.76 LTA4H (0.46) LTA4HDRD2DRD3MAPTKCNH2
SCHEMBL11153747 0.76 LTA4H (0.46) LTA4HDRD2DRD3MAPTKCNH2

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-5498741-A Alkyl aryl arylphosphonites, process for the preparation thereof and use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1996-03-12 US disclosed