SCHEMBL2604849

SCHEMBL2604849

CCCc1nc2ccccc2n1-c1ccc(-c2c3ccccc3c(-c3ccc(-c4cccc5ccccc45)cc3)c3ccccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
PPARG P37231 3/20 0.43
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
PDE10A Q9Y233 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
BLM P54132 1/20 0.41
USP2 O75604 2/20 0.40
LMNA P02545 2/20 0.40
MAPK1 P28482 1/20 0.40
MAPT P10636 1/20 0.40
AGTR1 P30556 2/20 0.40
AGTR2 P50052 2/20 0.40
FLT3 P36888 1/20 0.40

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
SCHEMBL2604822 0.96 MEN1 (0.44) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL2604848 0.91 KDM4E (0.42) MEN1KMT2ACYP1A2CNR1CNR2
SCHEMBL2604823 0.89 MEN1 (0.47) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL2604836 0.88 MEN1 (0.46) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL2604824 0.87 MEN1 (0.51) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL2604841 0.87 MEN1 (0.51) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL9976979 0.86 MEN1 (0.43) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL2604815 0.86 KDM4E (0.42) MEN1KMT2ACYP1A2CNR1CNR2
SCHEMBL26343533 0.85 KDM4E (0.41) MEN1KMT2ACYP1A2CNR1CNR2
SCHEMBL2604821 0.85 PDE10A (0.48) MEN1KMT2ACYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120091438-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-04-19 US disclosed
US-20120091438-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-04-19 US disclosed
US-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed
US-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed