SCHEMBL9633084

SCHEMBL9633084

CCCCCCCCCCCC(=O)N(CC)CCNC(C)CCOCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
KDM5A P29375 4/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
PHF8 Q9UPP1 3/20 0.34
DNM1 Q05193 3/20 0.34
KDM4C Q9H3R0 2/20 0.34
PLA2G2C Q5R387 2/20 0.34
FAAH O00519 2/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 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
SCHEMBL9633486 0.86 LMNA (0.39) LMNAKDM5AHDAC3HDAC4HDAC1
SCHEMBL9633174 0.80 LMNA (0.41) LMNAKDM5AHDAC3HDAC4HDAC1
SCHEMBL9633149 0.79 LMNA (0.48) LMNAKDM5AHDAC11PHF8DNM1
SCHEMBL9633089 0.79 PAOX (0.42) LMNAKDM5AHDAC3HDAC4HDAC1
SCHEMBL9633433 0.78 FAAH (0.48) DNM1FAAHMEN1MAPK1KMT2A
SCHEMBL9817192 0.73 LMNA (0.48) LMNAKDM5AHDAC3HDAC4HDAC1
SCHEMBL9817184 0.73 LMNA (0.48) LMNAKDM5AHDAC3HDAC4HDAC1
SCHEMBL21886876 0.73 LMNA (0.48) LMNAKDM5APHF8KDM4CFAAH
SCHEMBL3425770 0.73 DNM1 (0.46) LMNAHDAC11DNM1MEN1KMT2A
SCHEMBL24859122 0.72 LMNA (0.38) LMNAKDM5AHDAC3HDAC4HDAC1

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