SCHEMBL20089417

SCHEMBL20089417

CC(C)(C)c1c2ccc3ccccc3c2nc2c1ccc1ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 1/20 0.47
HPRT1 P00492 1/20 0.44
MAOA P21397 1/20 0.44
TSHR P16473 3/20 0.42
HSD17B10 Q99714 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
CYP2A6 P11509 2/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 2/20 0.41
CYP1B1 Q16678 2/20 0.41
CYP1A1 P04798 1/20 0.41
RAB9A P51151 2/20 0.38
HIF1A Q16665 2/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
ATM Q13315 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
SCHEMBL16801733 0.89 MAOA (0.50) L3MBTL1MAPTHPRT1MAOATSHR
SCHEMBL20095069 0.82 MAPT (0.35) L3MBTL1MAPTHPRT1MAOACYP1A2
SCHEMBL16232699 0.77 MAOA (0.66) L3MBTL1MAPTHPRT1MAOATSHR
SCHEMBL20089428 0.75 CCR4 (0.45) L3MBTL1MAPTMAOACYP1A2CYP1B1
SCHEMBL25878190 0.74 L3MBTL1 (0.46) L3MBTL1MAPTHPRT1MAOATSHR
SCHEMBL22097079 0.74 L3MBTL1 (0.42) L3MBTL1MAPTHPRT1MAOATSHR
SCHEMBL22249623 0.73 L3MBTL1 (0.41) L3MBTL1MAPTHPRT1MAOATSHR
SCHEMBL21557097 0.72 HPRT1 (0.50) L3MBTL1MAPTHPRT1MAOATSHR
SCHEMBL18650741 0.72 MAPT (0.56) L3MBTL1MAPTHPRT1MAOATSHR
SCHEMBL20080996 0.72 HPRT1 (0.50) L3MBTL1MAPTHPRT1MAOATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11011708-B2 Electron transport layer stack for an organic light-emitting diode NOVALED GMBH (DE) 2021-05-18 US disclosed
US-20180114920-A1 Electron Transport Layer Stack for an Organic Light-Emitting Diode NOVALED GMBH (DE) 2018-04-26 US disclosed
US-20180114920-A1 Electron Transport Layer Stack for an Organic Light-Emitting Diode NOVALED GMBH (DE) 2018-04-26 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-11011708-B2 Electron transport layer stack for an organic light-emitting diode SLCO4C1, SLC7A5, OCIAD1 L3MBTL1 1352/4885MAPT 434/4885HPRT1 1179/4885
US-20180114920-A1 Electron Transport Layer Stack for an Organic Light-Emitting Diode SLCO4C1, SLC7A5, OCIAD1 L3MBTL1 1352/4885MAPT 434/4885HPRT1 1179/4885

“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.