SCHEMBL8324974

SCHEMBL8324974

[CH2]C(NC)C(c1ccccc1)c1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
SLC6A4 P31645 2/20 0.40
NPC1 O15118 1/20 0.39
SLC6A2 P23975 1/20 0.37
ALDH1A1 P00352 4/20 0.36
CYP3A4 P08684 3/20 0.36
CYP2D6 P10635 3/20 0.36
CYP2C9 P11712 3/20 0.36
CYP2C19 P33261 3/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 3/20 0.36
HTT P42858 3/20 0.36
GAA P10253 1/20 0.36
MITF O75030 1/20 0.36
MAPT P10636 1/20 0.36
CHRM2 P08172 1/20 0.36
ADRA1A P35348 1/20 0.36
RGS12 O14924 1/20 0.36
GLA P06280 1/20 0.36

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
SCHEMBL8328722 0.84 IDO1 (0.42) SLC6A4SLC6A2KDM4ECNR2
SCHEMBL8327275 0.79 SLC6A4 (0.51) KMT2AMEN1SLC6A4NPC1SLC6A2
SCHEMBL8323402 0.79 PBRM1 (0.50) KMT2AMEN1NPC1ALDH1A1CYP3A4
SCHEMBL8326598 0.79 NPC1 (0.42) KMT2AMEN1SLC6A4NPC1ALDH1A1
SCHEMBL23209633 0.76 ALDH1A1 (0.46) KMT2AMEN1SLC6A4NPC1SLC6A2
SCHEMBL27669927 0.75 LMNA (0.43) NPC1ALDH1A1LMNAHTTNPSR1
SCHEMBL2122133 0.75 LMNA (0.43) NPC1ALDH1A1LMNAHTTNPSR1
SCHEMBL8325683 0.75 CYP3A4 (0.38) KMT2AMEN1ALDH1A1CYP3A4CYP2D6
SCHEMBL17069292 0.74 NPC1 (0.44) KMT2AMEN1SLC6A4NPC1ALDH1A1
SCHEMBL17069287 0.74 NPC1 (0.44) KMT2AMEN1SLC6A4NPC1ALDH1A1

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
EP-0948496-A2 SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE Amgen inc. (US) 1999-10-13 EP disclosed
WO-1998024780-A2 SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE AMGEN INC. (US) 1998-06-11 WO disclosed