SCHEMBL13480892

SCHEMBL13480892

Cn1c2ccccc2c2ccc(C=Cc3ccc(-c4ccc(C=Cc5ccc6c7ccccc7n(C)c6c5)cc4)cc3)cc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.53
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
KIF11 P52732 1/20 0.49
HPGD P15428 4/20 0.45
KDM4E B2RXH2 4/20 0.45
MAPT P10636 4/20 0.45
ALDH1A1 P00352 3/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
LMNA P02545 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 2/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.42
MEN1 O00255 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
PABPC1 P11940 1/20 0.42
TSHR P16473 1/20 0.41

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
SCHEMBL12419784 0.90 GPR3 (0.57) GPR3RXRARXRBKIF11HPGD
SCHEMBL11977563 0.84 KDM4E (0.54) HPGDKDM4EMAPTALDH1A1LMNA
SCHEMBL13480890 0.83 KDM4E (0.50) GPR3KIF11HPGDKDM4EMAPT
SCHEMBL12419783 0.83 GPR3 (0.57) GPR3KIF11HPGDKDM4EMAPT
SCHEMBL14366792 0.82 GPR3 (0.61) GPR3HPGDKDM4EMAPTALDH1A1
SCHEMBL28217032 0.81 GPR3 (0.55) GPR3HPGDKDM4EMAPTALDH1A1
SCHEMBL14077333 0.81 RXRA (0.46) GPR3RXRARXRBKIF11HPGD
SCHEMBL18473305 0.81 KDM4E (0.58) HPGDKDM4EMAPTALDH1A1LMNA
SCHEMBL12306232 0.81 KDM4E (0.58) HPGDKDM4EMAPTALDH1A1LMNA
SCHEMBL12892024 0.81 KIF11 (0.44) GPR3RXRARXRBKIF11HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7656084-B2 Method of producing laminated type organic electroluminescent element and display apparatus SEIKO EPSON CORPORATION (JP) 2010-02-02 US disclosed