SCHEMBL15087777

SCHEMBL15087777

CCNc1c(NCCO)c(=O)c1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 4/20 0.37
POLB P06746 3/20 0.37
GAA P10253 3/20 0.37
LMNA P02545 3/20 0.37
KDM4E B2RXH2 3/20 0.37
RAB9A P51151 2/20 0.37
GLA P06280 2/20 0.37
MITF O75030 1/20 0.37
TTR P02766 1/20 0.37
RAD52 P43351 1/20 0.37
GRIN2D O15399 4/20 0.34
GRIN3B O60391 4/20 0.34
GRIN1 Q05586 4/20 0.34
GRIN2A Q12879 4/20 0.34
GRIN2B Q13224 4/20 0.34
GRIN2C Q14957 4/20 0.34
GRIN3A Q8TCU5 4/20 0.34
PKM P14618 2/20 0.33

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
SCHEMBL10289305 0.83 MAPT (0.34) MAPK1TSHRALDH1A1POLBGAA
SCHEMBL21231244 0.77 ALDH1A1 (0.42) TSHRALDH1A1GAAKDM4EGRIN2D
SCHEMBL21842818 0.76 GPR84 (0.41) TSHRALDH1A1MAPT
SCHEMBL17662344 0.74 MAPK1 (0.36) MAPK1TSHRALDH1A1POLBGAA
SCHEMBL22645931 0.74 ALDH1A1 (0.40) TSHRALDH1A1POLBGAALMNA
SCHEMBL21472441 0.74
SCHEMBL22965148 0.74 GRIN2D (0.34) TSHRALDH1A1GRIN2DGRIN3BGRIN1
SCHEMBL24806218 0.74 HDAC1 (0.35) MAPK1TSHRALDH1A1POLBGAA
SCHEMBL22895170 0.74 GAA (0.46) MAPK1TSHRALDH1A1POLBGAA
SCHEMBL13918748 0.72 GAA (0.41) MAPK1ALDH1A1GAALMNAKDM4E

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-2610263-A1 Sialic acid dimers Brossmer, Reinhard (DE) 2013-07-03 EP disclosed