SCHEMBL18877007

SCHEMBL18877007

c1ccc2c(c1)ccc1c2c2c3ccccc3ccc2n1-c1nc2ccccc2nc1-c1ccc2c(c1)oc1ccccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
AHR P35869 2/20 0.34
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
HSP90AA1 P07900 1/20 0.33
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
GRK6 P43250 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
HCRTR1 O43613 1/20 0.33
ABCG2 Q9UNQ0 2/20 0.32
DUSP3 P51452 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32

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
SCHEMBL18877017 0.93 SIRT2 (0.37) TDP1L3MBTL1AHRKDM4EMAPT
SCHEMBL22989115 0.92 AHR (0.33) TDP1L3MBTL1AHRKDM4EMAPT
SCHEMBL24275443 0.92 TDP1 (0.33) TDP1L3MBTL1AHRKDM4EMAPT
SCHEMBL17533330 0.90 CASP1 (0.34) TDP1L3MBTL1AHRKDM4EMAPT
SCHEMBL24030108 0.89 TDP1 (0.31) TDP1L3MBTL1
SCHEMBL23471838 0.89 TDP1 (0.31) TDP1L3MBTL1
SCHEMBL24030184 0.89 TDP1 (0.31) TDP1L3MBTL1
SCHEMBL23471839 0.88 TDP1 (0.31) TDP1L3MBTL1
SCHEMBL18877039 0.88 L3MBTL1 (0.36) TDP1L3MBTL1AHRKDM4EMAPT
SCHEMBL23030696 0.87 PRKDC (0.33) AHRKDM4EMAPTPOLBMEN1

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 5 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-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

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 TDP1 1291/4885L3MBTL1 684/4885AHR 3211/4885
US-20170148998-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME OR10J3, OPA1, ODC1 TDP1 1291/4885L3MBTL1 684/4885AHR 3211/4885

“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.