SCHEMBL9633196

SCHEMBL9633196

CCCCCCCCCCCC(=O)N(CCO)CCNCCO

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.43
KDM5A P29375 3/20 0.40
PHF8 Q9UPP1 3/20 0.40
KDM4C Q9H3R0 2/20 0.40
NAAA Q02083 1/20 0.40
PAOX Q6QHF9 2/20 0.40
SELP P16109 1/20 0.39
CNR1 P21554 4/20 0.38
CNR2 P34972 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
TRPV1 Q8NER1 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
ALOX12 P18054 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL9633650 0.91 LMNA (0.44) DNM1KDM5APHF8KDM4CNAAA
SCHEMBL11502569 0.90 KDM5A (0.47) KDM5APHF8KDM4CALDH1A1MEN1
SCHEMBL14937709 0.88 KDM5A (0.46) KDM5APHF8KDM4CALDH1A1MEN1
SCHEMBL25412654 0.88 PAOX (0.46) DNM1KDM5APHF8KDM4CNAAA
SCHEMBL14937708 0.87 GPR84 (0.40) DNM1KDM5APHF8KDM4C
SCHEMBL1914764 0.87 KDM5A (0.43) KDM5APHF8KDM4CALDH1A1MEN1
SCHEMBL5806921 0.87 KDM5A (0.47) KDM5APHF8KDM4CALDH1A1MEN1
SCHEMBL1914762 0.87 KDM5A (0.47) KDM5APHF8KDM4CALDH1A1MEN1
SCHEMBL5807681 0.87 KDM5A (0.47) KDM5APHF8KDM4CALDH1A1MEN1
SCHEMBL284784 0.87 CES2 (0.48) CNR1ALDH1A1MEN1KMT2ATDP1

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