SCHEMBL365855

SCHEMBL365855

N=C(N)c1c2ccccc2n2cc(O)ccc12

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
EGFR P00533 2/20 0.33
SRC P12931 1/20 0.33
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSP90AA1 P07900 2/20 0.31
F10 P00742 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31
ADRA1A P35348 1/20 0.31
F2 P00734 1/20 0.31
F12 P00748 1/20 0.31
F7 P08709 1/20 0.31
F3 P13726 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL367201 0.84 EGFR (0.45) EGFRSRC
SCHEMBL366888 0.79 EGFR (0.44) EGFRSRCMEN1KMT2A
SCHEMBL365854 0.75 KDM4E (0.55) LMNAEGFRSRCMEN1MAPT
SCHEMBL364931 0.74 NR4A2 (0.50) LMNAEGFRSRCMEN1MAPT
SCHEMBL30386248 0.73 KDM4E (0.39) LMNAMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL365622 0.71 CA12 (0.46) MEN1MAPTKMT2AADORA3F2
SCHEMBL364761 0.71 KDM4E (0.52) LMNAMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL365400 0.69 ELANE (0.47) LMNAMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL364542 0.69 ALDH1A1 (0.59) LMNAEGFRSRCMEN1MAPT
SCHEMBL367764 0.68 EGFR (0.45) LMNAEGFRSRCMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed