SCHEMBL19148271

SCHEMBL19148271

C(Cc1ccccn1)=Nc1cccc2cccnc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.44
MAPT P10636 5/20 0.44
LMNA P02545 4/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 3/20 0.44
ESR1 P03372 1/20 0.44
POLB P06746 1/20 0.44
AGTR1 P30556 1/20 0.44
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
RAB9A P51151 5/20 0.40
NPC1 O15118 4/20 0.40
HTT P42858 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
MMP2 P08253 2/20 0.39
TSHR P16473 2/20 0.39
GMNN O75496 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL18489530 0.84 LMNA (0.45) KDM4EMAPTLMNAMEN1KMT2A
SCHEMBL21113655 0.79 KDM4E (0.39) KDM4EMAPTLMNAMEN1KMT2A
SCHEMBL16835711 0.77 CYP2C9 (0.45) KDM4EMAPTLMNAMEN1KMT2A
SCHEMBL16096261 0.75 SYK (0.45) KDM4EMAPTLMNAMEN1KMT2A
SCHEMBL11764855 0.74 NR4A1 (0.54) KDM4EMAPTLMNAMEN1KMT2A
SCHEMBL11764865 0.74 NR4A1 (0.54) KDM4EMAPTLMNAMEN1KMT2A
SCHEMBL16097907 0.73 SCN8A (0.44) KDM4EMEN1KMT2AALDH1A1RAB9A
SCHEMBL18543873 0.73 KDM4E (0.37) KDM4EMAPTLMNAMEN1KMT2A
SCHEMBL6243528 0.73 MAOA (0.50) MAPTLMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL28439758 0.72 KDM4E (0.43) KDM4EMAPTLMNAMEN1KMT2A

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-2017125569-A1 PROCESS FOR PREPARING ORGANIC ELECTROLUMINESCENT MOLECULES ECOLE POLYTECHNIQUE (FR) 2017-07-27 WO disclosed
WO-2017125572-A1 ORGANIC ELECTROLUMINESCENT MOLECULES ECOLE POLYTECHNIQUE (FR) 2017-07-27 WO disclosed