SCHEMBL28071405

SCHEMBL28071405

CC(C)CCNNCCC(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
ANPEP P15144 3/20 0.33
RNPEP Q9H4A4 2/20 0.33
DNPEP Q9ULA0 2/20 0.33
CYP2D6 P10635 1/20 0.33
GLB1 P16278 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
GAA P10253 1/20 0.31
CA1 P00915 1/20 0.30
L3MBTL1 Q9Y468 2/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL24348241 0.87
SCHEMBL29008421 0.87 ANPEP (0.32) ANPEPDNPEPCYP2D6CYP2C19
Hydrochloric Acid SCHEMBL11553301 0.85 DNM1 (0.32) GLB1
SCHEMBL28954757 0.83 TSHR (0.38) LMNAALDH1A1CYP3A4CYP2C19GAA
SCHEMBL13914404 0.81
SCHEMBL40975 0.77 LMNA (0.35) LMNAANPEPRNPEPDNPEPCYP2D6
SCHEMBL18165018 0.76
SCHEMBL21116570 0.76
SCHEMBL29123877 0.76 LMNA (0.50) LMNA
SCHEMBL3296405 0.74 LMNA (0.33) LMNAANPEPRNPEPDNPEPCYP2D6

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110150760-A A kind of aerosol generation system 钟术光 2019-08-23 CN claimed
CN-106139155-A The pharmaceutical carrier of slow-release 钟术光 2016-11-23 CN disclosed
CN-106075457-A The pharmaceutical carrier of slow-release 钟术光 2016-11-09 CN disclosed
CN-106074417-A The pharmaceutical carrier of slow-release 钟术光 2016-11-09 CN disclosed
CN-102698277-B Drug carrier for sustained release of drug 钟术光 2016-08-03 CN disclosed