SCHEMBL11265416

SCHEMBL11265416

CCCCCCCCCCCCCCC(O)CNCCN1CCN=CC(C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.36
PDCD4 Q53EL6 1/20 0.33
EPHX2 P34913 1/20 0.32
PTGER4 P35408 3/20 0.31
PTGER3 P43115 3/20 0.31
PTGER2 P43116 3/20 0.31
HIF1A Q16665 1/20 0.31
EPAS1 Q99814 1/20 0.31
MMP1 P03956 3/20 0.30
MMP3 P08254 3/20 0.30
ADRB3 P13945 1/20 0.30
DAGLA Q9Y4D2 1/20 0.30

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
SCHEMBL11256823 0.94 GBA1 (0.35) GBA1PDCD4EPHX2PTGER4PTGER3
SCHEMBL11254434 0.86 PDCD4 (0.34) GBA1PDCD4EPHX2PTGER4PTGER3
SCHEMBL11254432 0.86 PDCD4 (0.34) GBA1PDCD4EPHX2PTGER4PTGER3
SCHEMBL11261529 0.83 GBA1 (0.39) GBA1PDCD4HIF1AEPAS1DAGLA
SCHEMBL11264244 0.79 PTGER4 (0.33) PDCD4EPHX2PTGER4PTGER3PTGER2
SCHEMBL11255097 0.79 EPHX2 (0.32) PDCD4EPHX2DAGLA
SCHEMBL11264246 0.79 PTGER4 (0.33) PDCD4EPHX2PTGER4PTGER3PTGER2
SCHEMBL11265414 0.78 GBA1 (0.32) GBA1PDCD4HIF1AEPAS1DAGLA
SCHEMBL11260896 0.78 PLD1 (0.42)
SCHEMBL11262212 0.74 ALDH1A1 (0.35) GBA1EPHX2PTGER4PTGER3PTGER2

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-4346087-A CORROSION RESISTANCE TOHO CHEMICAL INDUSTRY CO., LTD. (JP) 1982-08-24 US claimed
US-4346087-A CORROSION RESISTANCE TOHO CHEMICAL INDUSTRY CO., LTD. (JP) 1982-08-24 US disclosed