SCHEMBL6005763

SCHEMBL6005763

CCCNCN1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.41
PRMT6 Q96LA8 1/20 0.41
PRMT8 Q9NR22 1/20 0.41
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
DPP4 P27487 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
TLR8 Q9NR97 1/20 0.30
TLR7 Q9NYK1 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ACHE P22303 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
SCHEMBL9603471 0.82 ALDH1A1 (0.48) ALDH1A1KDM4EDPP4TSHR
SCHEMBL19032451 0.82 ALDH1A1 (0.48) ALDH1A1KDM4EDPP4TSHR
SCHEMBL8398744 0.81 KDM4E (0.37) ALDH1A1KDM4ETLR8TLR7NPSR1
SCHEMBL8121341 0.79
SCHEMBL7446808 0.78 CARM1 (0.56) CARM1PRMT6PRMT8KMT2AALDH1A1
SCHEMBL15767946 0.77 CARM1 (0.37) CARM1PRMT6PRMT8LMNAMEN1
SCHEMBL15768040 0.77 CARM1 (0.37) CARM1PRMT6PRMT8LMNAMEN1
SCHEMBL12302972 0.76 CARM1 (0.54) CARM1PRMT6PRMT8ALDH1A1KDM4E
SCHEMBL26442095 0.76 SLC2A1 (0.35)
SCHEMBL6739265 0.75 CARM1 (0.46) CARM1PRMT6PRMT8LMNAALDH1A1

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
WO-2006009143-A1 PROCESS FOR PRODUCTION OF (3S)-3-HYDROXYMETHYL-7-OXO- PYRIDOBENZOXAZINE-6-CARBOXYLIC ESTERS KYORIN PHARMACEUTICAL CO., LTD. (JP) 2006-01-26 WO disclosed