SCHEMBL16341983

SCHEMBL16341983

NCC(CCCCCCCCCCCCCCCCCCCCCC(N)=O)NCCCCCCCCCCCCCCCCCCCCCC(N)=O.NCCCCCC(CCCCCCCCCCCCCCCCCC(N)=O)NCCCCCCCCCCCCCCCCCC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
PAOX Q6QHF9 4/20 0.41
HDAC6 Q9UBN7 1/20 0.38
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
PLG P00747 1/20 0.37
LMNA P02545 1/20 0.37
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
SLC6A2 P23975 1/20 0.37
RECQL P46063 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KMT2A Q03164 1/20 0.37
DNM1 Q05193 1/20 0.35
SIRT6 Q8N6T7 1/20 0.35
SIRT1 Q96EB6 1/20 0.35

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
SCHEMBL1149790 0.95 MAOA (0.47) MAOAMAOBPAOXHDAC6GNAI3
SCHEMBL1149662 0.93 MAOA (0.40) MAOAMAOBPAOXHDAC6GNAI3
SCHEMBL1149755 0.93 MAOA (0.40) MAOAMAOBPAOXHDAC6GNAI3
SCHEMBL3230102 0.93 MAOA (0.40) MAOAMAOBPAOXHDAC6GNAI3
SCHEMBL377177 0.93 MAOA (0.40) MAOAMAOBPAOXHDAC6GNAI3
SCHEMBL1149619 0.84 FAAH (0.47) MAOAMAOBMEN1ALDH1A1KMT2A
SCHEMBL8736060 0.83 LMNA (0.59) PAOXHDAC6GNAI3GNAO1GNAI1
SCHEMBL7438479 0.83 LMNA (0.59) PAOXHDAC6GNAI3GNAO1GNAI1
SCHEMBL9079383 0.81 PRMT1 (0.46) HDAC6MEN1ALDH1A1PLGLMNA
SCHEMBL9079401 0.81 PRMT1 (0.46) HDAC6MEN1ALDH1A1PLGLMNA

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
EP-2226358-B1 POLYACETAL RESIN COMPOSITION POLYPLASTICS CO (JP) 2015-01-07 EP disclosed