SCHEMBL12367180

SCHEMBL12367180

c1ccc(-c2c3c(c(-c4ccccc4)c4cc(-c5ccccn5)ccc24)-c2cccc4c(-c5ccc6c(c5)-c5cccc7cccc-6c57)ccc-3c24)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.35
LMNA P02545 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PRMT5 O14744 2/20 0.34
DHODH Q02127 1/20 0.34
PDK2 Q15119 1/20 0.34
TGFBR1 P36897 1/20 0.34
MAPK1 P28482 5/20 0.33
HSD17B10 Q99714 5/20 0.33
ALDH1A1 P00352 4/20 0.33
NPC1 O15118 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TP53 P04637 2/20 0.33
BRD4 O60885 1/20 0.33
PRKDC P78527 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 4/20 0.33
CASP3 P42574 1/20 0.33

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
SCHEMBL13335817 0.90 PDK2 (0.35) HPGDLMNAMEN1KMT2APRMT5
SCHEMBL12367181 0.90 TGFBR1 (0.38) HPGDLMNADHODHPDK2TGFBR1
SCHEMBL12367178 0.89 PDK2 (0.36) HPGDLMNAMEN1KMT2ADHODH
SCHEMBL12269907 0.88 PDK2 (0.36) HPGDLMNAMEN1KMT2APRMT5
SCHEMBL12021378 0.85 HPGD (0.39) HPGDLMNAMEN1KMT2APRMT5
SCHEMBL12269911 0.85 HPGD (0.35) HPGDLMNAMEN1KMT2APRMT5
SCHEMBL11992102 0.84 LMNA (0.42) HPGDLMNAMEN1KMT2ADHODH
SCHEMBL12367179 0.84 NPC1 (0.36) HPGDLMNAMEN1KMT2APRMT5
SCHEMBL2620618 0.84 TGFBR1 (0.40) HPGDPRMT5DHODHPDK2TGFBR1
SCHEMBL12586138 0.84 HPGD (0.47) HPGDLMNAMEN1KMT2APRMT5

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
US-20110198582-A1 ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2011-08-18 US disclosed
US-20110198582-A1 ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2011-08-18 US disclosed