SCHEMBL18221906

SCHEMBL18221906

[c]1cccc2cc3c4ccccc4c4ccccc4c3cc12

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
HSD17B10 Q99714 4/20 0.39
HIF1A Q16665 1/20 0.39
CYP1B1 Q16678 1/20 0.39
HPRT1 P00492 4/20 0.37
TRPM4 Q8TD43 1/20 0.35
CYP2A6 P11509 3/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP1A2 P05177 4/20 0.34
HPGD P15428 2/20 0.34
THRB P10828 1/20 0.34
PAX8 Q06710 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTR2A P28223 1/20 0.30
NQO1 P15559 1/20 0.30
NQO2 P16083 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL194850 0.93 ALDH1A1 (0.36) ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
SCHEMBL510364 0.84 ALDH1A1 (0.39) ALDH1A1HSD17B10HIF1ACYP1B1HPRT1
SCHEMBL21464320 0.83 ALDH1A1 (0.46) ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
SCHEMBL1901239 0.82 ALDH1A1 (0.56) ALDH1A1HSD17B10HIF1ACYP1B1HPRT1
SCHEMBL6552445 0.82 ALDH1A1 (0.61) ALDH1A1HSD17B10HIF1ACYP1B1HPRT1
SCHEMBL194896 0.82 ALDH1A1 (0.45) ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
SCHEMBL756551 0.81 CYP2A6 (0.32) CYP2A6
SCHEMBL18832 0.79 ALDH1A1 (0.36) ALDH1A1HSD17B10HIF1ACYP2A6TSHR
SCHEMBL27813028 0.79 ALDH1A1 (0.46) ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6
SCHEMBL1921671 0.79 ALDH1A1 (0.32) ALDH1A1CYP2A6HPGD

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
EP-3294727-B1 ORGANIC LIGHT-EMITTING DIODE COMPRISING DIFFERENT MATRIX COMPOUNDS IN THE FIRST AND SECOND ELECTRON TRANSPORT LAYER NOVALED GMBH (DE) 2021-08-04 EP claimed
EP-3093288-A1 ORGANIC LIGHT-EMITTING DIODE COMPRISING DIFFERENT MATRIX COMPOUNDS IN THE FIRST AND SECOND ELECTRON TRANSPORT LAYER Novaled GmbH (DE) 2016-11-16 EP claimed
EP-3294727-B1 ORGANIC LIGHT-EMITTING DIODE COMPRISING DIFFERENT MATRIX COMPOUNDS IN THE FIRST AND SECOND ELECTRON TRANSPORT LAYER NOVALED GMBH (DE) 2021-08-04 EP disclosed
US-11081652-B2 Organic light-emitting diode comprising different matrix compounds in the first and second electron transport layer NOVALED GMBH (DE) 2021-08-03 US disclosed
US-20180145263-A1 Organic Light-Emitting Diode Comprising Different Matrix Compounds in the First and Second Electron Transport Layer NOVALED GMBH (DE) 2018-05-24 US disclosed
EP-3294727-A1 ORGANIC LIGHT-EMITTING DIODE COMPRISING DIFFERENT MATRIX COMPOUNDS IN THE FIRST AND SECOND ELECTRON TRANSPORT LAYER Novaled GmbH (DE) 2018-03-21 EP disclosed
WO-2016180891-A1 ORGANIC LIGHT-EMITTING DIODE COMPRISING DIFFERENT MATRIX COMPOUNDS IN THE FIRST AND SECOND ELECTRON TRANSPORT LAYER NOVALED GMBH (DE) 2016-11-17 WO disclosed
EP-3093288-A1 ORGANIC LIGHT-EMITTING DIODE COMPRISING DIFFERENT MATRIX COMPOUNDS IN THE FIRST AND SECOND ELECTRON TRANSPORT LAYER Novaled GmbH (DE) 2016-11-16 EP 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-11081652-B2 Organic light-emitting diode comprising different matrix compounds in the first and second electron transport layer CYBA, CLTB, MAP1LC3B ALDH1A1 122/4885HSD17B10 442/4885HIF1A 3349/4885
US-20180145263-A1 Organic Light-Emitting Diode Comprising Different Matrix Compounds in the First and Second Electron Transport Layer CYBA, CLTB, MAP1LC3B ALDH1A1 122/4885HSD17B10 442/4885HIF1A 3349/4885

“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.