SCHEMBL7960787

SCHEMBL7960787

O=C1CN(P)c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.53
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
PABPC1 P11940 1/20 0.39
BLM P54132 1/20 0.39
KCNA3 P22001 6/20 0.38
KCNN4 O15554 5/20 0.38
TDP1 Q9NUW8 1/20 0.38
CES1 P23141 3/20 0.36
TTR P02766 1/20 0.36
BCHE P06276 1/20 0.35
TGM2 P21980 1/20 0.35
CDC25B P30305 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
SCHEMBL10246639 0.79 LMNA (0.45) NOTUMKMT2AMEN1KDM4EALDH1A1
SCHEMBL20622381 0.76 KMT2A (0.50) NOTUMKMT2AMEN1ALDH1A1MAPT
SCHEMBL28855145 0.74 NOTUM (0.58) NOTUMKMT2AMEN1KDM4EALDH1A1
SCHEMBL30776885 0.74 NOTUM (0.58) NOTUMKMT2AMEN1KDM4EALDH1A1
SCHEMBL6366299 0.74 NOTUM (0.58) NOTUMKMT2AMEN1KDM4EALDH1A1
SCHEMBL3940567 0.71 NPC1 (0.52) NOTUMKMT2AMEN1KDM4EALDH1A1
SCHEMBL6126239 0.69 NOTUM (0.53) NOTUMKMT2AMEN1KDM4EALDH1A1
SCHEMBL6360254 0.69 NOTUM (0.53) NOTUMKMT2AMEN1KDM4EALDH1A1
SCHEMBL1048074 0.69 NOTUM (1.00) NOTUMKDM4EALDH1A1KCNA3KCNN4
SCHEMBL14516311 0.69 NOTUM (0.53) NOTUMKMT2AMEN1KDM4EALDH1A1

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-2010015585-A1 6-BENZYL-2,3,4,7-TETRAHYDRO-INDOLO[2,3-C]QUINOLINE COMPOUNDS NYCOMED GMBH (DE) 2010-02-11 WO disclosed
WO-2010015588-A1 BENZYL-SUBSTITUTED TETRACYCLIC HETEROCYCLIC COMPOUNDS NYCOMED GMBH (DE) 2010-02-11 WO disclosed