SCHEMBL17451986

SCHEMBL17451986

O=P(c1ccccc1)(c1ccc(-c2cccc3cccnc23)cc1)c1ccc(-c2cccc3cccnc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 1/20 0.47
MMP9 P14780 2/20 0.44
LMNA P02545 2/20 0.44
MMP2 P08253 2/20 0.44
TSHR P16473 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GMNN O75496 1/20 0.44
TP53 P04637 1/20 0.44
HSP90AA1 P07900 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
NFKB1 P19838 1/20 0.44
MMP8 P22894 1/20 0.44
CCR1 P32246 1/20 0.44
THPO P40225 1/20 0.44
MTOR P42345 1/20 0.44
HTT P42858 1/20 0.44
MMP13 P45452 1/20 0.44

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
SCHEMBL19009599 0.90 TOP1 (0.44) ENPP1MMP9KDM4EMAPTKDR
SCHEMBL17451947 0.88 TOP1 (0.44) ENPP1MMP9LMNAMMP2TSHR
SCHEMBL30592746 0.85 MMP2 (0.56) ENPP1MMP9LMNAMMP2TSHR
SCHEMBL12074320 0.85 MMP2 (0.56) ENPP1MMP9LMNAMMP2TSHR
SCHEMBL17403770 0.82 MMP2 (0.46) MMP9LMNAMMP2TSHRKDM4E
SCHEMBL4148271 0.82 MMP2 (0.60) ENPP1MMP9LMNAMMP2TSHR
SCHEMBL20249857 0.80 METAP2 (0.39) ENPP1MMP9TSHRMAPTHTT
SCHEMBL17451930 0.80 TOP1 (0.44) MMP9LMNAMMP2TSHRKDM4E
SCHEMBL27816291 0.80 MMP2 (0.58) ENPP1MMP9LMNAMMP2TSHR
SCHEMBL20108867 0.80 LMNA (0.40) MMP9LMNAMMP2TSHRKDM4E

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