SCHEMBL19009485

SCHEMBL19009485

O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2ccc(-c3nc4ccccc4c4ccc5ccccc5c34)c3ccccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.36
DHODH Q02127 5/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 3/20 0.34
HPGD P15428 1/20 0.34
TOP1 P11387 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
HSP90AA1 P07900 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL17035161 0.90 DHODH (0.40) TOP2ADHODHKDM4EMAPTLMNA
SCHEMBL18200623 0.82 DHODH (0.40) DHODHKDM4EALDH1A1LMNAGAA
SCHEMBL17034894 0.82 DHODH (0.40) DHODHKDM4EALDH1A1LMNAGAA
SCHEMBL18200622 0.82 DHODH (0.40) DHODHKDM4EALDH1A1LMNAGAA
SCHEMBL19009851 0.77 MAPT (0.37) TOP2ADHODHKDM4EALDH1A1MAPT
SCHEMBL18200831 0.77 MAPT (0.37) DHODHKDM4EALDH1A1MAPTHPGD
SCHEMBL17035162 0.76 CYP1A2 (0.41) TOP2ADHODHKDM4EALDH1A1MAPT
SCHEMBL17451892 0.76 GPR84 (0.40) KDM4EALDH1A1MAPTHPGDTOP1
SCHEMBL18200991 0.76 DHODH (0.36) DHODHTOP1
SCHEMBL16628450 0.76 CYP1A2 (0.39) KDM4EALDH1A1MAPTHPGDTOP1

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-20170179402-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 US disclosed
US-20170179402-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 US disclosed