SCHEMBL17452053

SCHEMBL17452053

O=P(c1ccccc1)(c1ccc(-c2ccccn2)cc1)c1cccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
LMNA P02545 2/20 0.50
POLB P06746 1/20 0.50
DHODH Q02127 1/20 0.44
TOP1 P11387 1/20 0.41
CYP2C9 P11712 3/20 0.41
MAPK1 P28482 3/20 0.40
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HSD17B10 Q99714 2/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
GRM5 P41594 1/20 0.38
CASP3 P42574 1/20 0.38
CASP7 P55210 1/20 0.38
ALPL P05186 1/20 0.38
HSP90AA1 P07900 1/20 0.38
ALPI P09923 1/20 0.38

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
SCHEMBL17451968 0.86 KDM4E (0.41) KDM4ELMNAPOLBTOP1CYP2C9
SCHEMBL5760742 0.84 TOP1 (0.43) KDM4ELMNAPOLBTOP1SMN1; SMN2
SCHEMBL17451977 0.83 TOP1 (0.44) KDM4ELMNAPOLBTOP1CYP2C9
SCHEMBL17451881 0.82 TOP1 (0.42) KDM4ELMNAPOLBTOP1MAPK1
SCHEMBL13276249 0.82 CYP2A6 (0.47) KDM4ELMNAPOLBDHODHCYP2C9
SCHEMBL14339295 0.82 LMNA (0.46) KDM4ELMNAPOLBTOP1CYP2C9
SCHEMBL17451944 0.82 KDM4E (0.43) KDM4ELMNAPOLBDHODHTOP1
SCHEMBL14339276 0.81 LMNA (0.45) KDM4ELMNAPOLBTOP1CYP2C9
SCHEMBL14339278 0.81 LMNA (0.45) KDM4ELMNAPOLBTOP1CYP2C9
SCHEMBL14339284 0.81 LMNA (0.45) KDM4ELMNAPOLBTOP1CYP2C9

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-20160020405-A1 ORGANIC LIGHT EMITTING ELEMENT AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-01-21 US disclosed
US-20160020405-A1 ORGANIC LIGHT EMITTING ELEMENT AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-01-21 US disclosed