SCHEMBL28097906

SCHEMBL28097906

CCNC(CO)C(C)CC

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
CNR1 P21554 1/20 0.37
ADRA1A P35348 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ABCC3 O15438 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TRPV3 Q8NET8 2/20 0.35
TSHR P16473 2/20 0.32

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
SCHEMBL10282635 1.00 LMNA (0.37) LMNATDP1CNR1ADRA1AKDM4E
SCHEMBL730154 0.81 LMNA (0.39) LMNATDP1CNR1ADRA1AKDM4E
SCHEMBL10282636 0.79
SCHEMBL10282653 0.79
SCHEMBL13743167 0.79
SCHEMBL10282535 0.77
SCHEMBL13502647 0.77
SCHEMBL18940532 0.77
SCHEMBL16925084 0.77
SCHEMBL10412635 0.77

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
CN-105939736-A ODOUR-MASKED AMINE COMPOSITION 阿肯马法国公司 2016-09-14 CN disclosed