SCHEMBL9633191

SCHEMBL9633191

CCCCCCCC(=O)NCCNCCO

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.62
SELP P16109 1/20 0.62
FAAH O00519 4/20 0.61
CNR1 P21554 2/20 0.60
ALDH1A1 P00352 2/20 0.60
HPGD P15428 2/20 0.60
TRPV1 Q8NER1 1/20 0.60
MEN1 O00255 1/20 0.60
MAPT P10636 1/20 0.60
ALOX12 P18054 1/20 0.60
BLM P54132 1/20 0.60
KMT2A Q03164 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
DNM1 Q05193 2/20 0.60
CASP2 P42575 1/20 0.56

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
SCHEMBL8429050 1.00 NAAA (0.62) NAAASELPFAAHCNR1ALDH1A1
SCHEMBL5418052 1.00 NAAA (0.62) NAAASELPFAAHCNR1ALDH1A1
SCHEMBL21170565 1.00 NAAA (0.62) NAAASELPFAAHCNR1ALDH1A1
Propionic Acid SCHEMBL28674969 0.94 SELP (0.56) NAAASELPFAAHCNR1ALDH1A1
SCHEMBL10038806 0.93 NAAA (0.62) NAAASELPFAAHCNR1ALDH1A1
SCHEMBL9633843 0.93 NAAA (0.56) NAAASELPFAAHCNR1ALDH1A1
SCHEMBL15463170 0.93 FAAH (0.69) NAAASELPFAAHCNR1ALDH1A1
SCHEMBL21682798 0.93 FAAH (0.69) NAAASELPFAAHCNR1ALDH1A1
SCHEMBL19513937 0.93 FAAH (0.69) NAAASELPFAAHCNR1ALDH1A1
SCHEMBL20801622 0.93 FAAH (0.69) NAAASELPFAAHCNR1ALDH1A1

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