SCHEMBL17533335

SCHEMBL17533335

c1ccc2c(c1)ccc1c2c2c3ccccc3ccc2n1-c1ccc(-c2nc3ccccc3nc2-c2ccc3sc4ccccc4c3c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.33
KDM4E B2RXH2 2/20 0.33
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
HTT P42858 2/20 0.33
POLB P06746 1/20 0.33
HSP90AA1 P07900 1/20 0.33
PKM P14618 1/20 0.33
GRK6 P43250 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
ALDH1A1 P00352 2/20 0.32
THRB P10828 1/20 0.32
GPR3 P46089 1/20 0.31
NQO1 P15559 1/20 0.31
NQO2 P16083 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPC1 O15118 1/20 0.31
HPGD P15428 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
SCHEMBL18877036 0.93 MAPT (0.33) LMNAKDM4EGAAMAPTHTT
SCHEMBL18877059 0.91 LMNA (0.34) LMNAKDM4EGAAMAPTHTT
SCHEMBL21717009 0.88
SCHEMBL18876978 0.88 PIM3 (0.31)
SCHEMBL18877116 0.88 LMNA (0.33) LMNAKDM4EGAAMAPTHTT
SCHEMBL16870688 0.87 LMNA (0.33) LMNAKDM4EGAAL3MBTL1ALDH1A1
SCHEMBL18876896 0.87 ATM (0.39) LMNAMAPTHTTNQO1NQO2
SCHEMBL17642105 0.87 GPR3 (0.37) KDM4EMAPTL3MBTL1ALDH1A1GPR3
SCHEMBL22989058 0.85 HPGD (0.33) HPGDPDE10A
SCHEMBL17533243 0.85 KDM4E (0.31) LMNAKDM4EGAAMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10186669-B2 Organic electroluminescent compound and an organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD (KR) 2019-01-22 US disclosed
US-9997723-B2 Organic electroluminescent compound and an organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD (KR) 2018-06-12 US disclosed
US-9997723-B2 Organic electroluminescent compound and an organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD (KR) 2018-06-12 US disclosed
US-20170279056-A1 A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-09-28 US disclosed
US-20170279056-A1 A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-09-28 US disclosed
US-20170148998-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-05-25 US disclosed
US-20170148998-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-05-25 US disclosed
WO-2016028110-A1 A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2016-02-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10186669-B2 Organic electroluminescent compound and an organic electroluminescent device comprising the same OR10J3, OPA1, ODC1 LMNA 1834/4885KDM4E 885/4885GAA 1315/4885
US-20170148998-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME OR10J3, OPA1, ODC1 LMNA 1834/4885KDM4E 885/4885GAA 1315/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.