SCHEMBL9633097

SCHEMBL9633097

CCCCCCCCCCCC(=O)N(CC)C(C)NCCCCOCC

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 8/20 0.40
CES2 O00748 1/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
FAAH O00519 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
PLA2G2C Q5R387 2/20 0.35
SPHK1 Q9NYA1 1/20 0.35
TSHR P16473 1/20 0.35
DGKA P23743 1/20 0.34

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
SCHEMBL9633499 0.85 EPHX2 (0.42) EPHX2LMNAMEN1FAAHMAPK1
SCHEMBL9633446 0.77 FAAH (0.53) EPHX2MEN1FAAHMAPK1KMT2A
SCHEMBL9633089 0.73 PAOX (0.42) CES2LMNA
SCHEMBL9633084 0.72 LMNA (0.36) EPHX2LMNAMEN1FAAHMAPK1
SCHEMBL25836455 0.71 EPHX2 (0.56) EPHX2CES2LMNAMEN1FAAH
SCHEMBL19687365 0.71 CASP2 (0.62) EPHX2FAAH
SCHEMBL17624918 0.69 CASP2 (0.59) EPHX2FAAHTSHR
SCHEMBL31060424 0.69 PLA2G2A (0.67) EPHX2CES2
Arachidic Acid SCHEMBL28744356 0.69 GPR84 (0.53) EPHX2MEN1KMT2ATSHR
SCHEMBL8345106 0.69 USP2 (0.51) EPHX2CES2LMNAMEN1KMT2A

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-5162315-A Topical administration of diltiazem THERAPEUTIC PATCH RESEARCH N.V. 1992-11-10 US disclosed