SCHEMBL430447

SCHEMBL430447

c1ccc(-c2cccc3c2oc2c(-c4cc5ccccc5c5ccccc45)cccc23)c(-c2ccccc2-c2cccc3c2oc2c(-c4cc5ccccc5c5ccccc45)cccc23)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.55
HSD17B10 Q99714 5/20 0.55
TSHR P16473 4/20 0.55
HIF1A Q16665 3/20 0.55
MAPK1 P28482 3/20 0.55
HPGD P15428 2/20 0.55
CASP1 P29466 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
ALOX5 P09917 2/20 0.42
TRPM4 Q8TD43 1/20 0.41
CYP1B1 Q16678 1/20 0.40
CYP11B1 P15538 1/20 0.40
HPRT1 P00492 1/20 0.38
TP53 P04637 1/20 0.38
CASP7 P55210 1/20 0.38
NISCH Q9Y2I1 1/20 0.38
MAOA P21397 2/20 0.37
ACHE P22303 2/20 0.37
ERBB2 P04626 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL1635701 0.94 ALDH1A1 (0.48) ALDH1A1HSD17B10TSHRHIF1AMAPK1
SCHEMBL18819945 0.90 ALDH1A1 (0.59) ALDH1A1HSD17B10TSHRHIF1AMAPK1
SCHEMBL4549368 0.90 ALOX5 (0.56) ALDH1A1HSD17B10TSHRHIF1AMAPK1
SCHEMBL14476530 0.90 ALDH1A1 (0.53) ALDH1A1HSD17B10TSHRHIF1AMAPK1
SCHEMBL4549396 0.90 ALOX5 (0.56) ALDH1A1HSD17B10TSHRHIF1AMAPK1
SCHEMBL1635355 0.87 ALOX5 (0.46) ALDH1A1HSD17B10TSHRHIF1AMAPK1
SCHEMBL16302981 0.87 ALOX5 (0.58) ALDH1A1HSD17B10TSHRHIF1AMAPK1
SCHEMBL1637794 0.86 ALOX5 (0.45) ALDH1A1HSD17B10TSHRHIF1AMAPK1
SCHEMBL4549370 0.86 ALOX5 (0.56) ALDH1A1HSD17B10TSHRHIF1AMAPK1
SCHEMBL25050983 0.85 ALOX5 (0.44) ALDH1A1HSD17B10TSHRHIF1AMAPK1

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-9406893-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-08-02 US disclosed
US-9406893-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-08-02 US disclosed
US-20140299861-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2014-10-09 US disclosed
US-20140299861-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2014-10-09 US disclosed
US-8790794-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-07-29 US disclosed
US-8790794-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-07-29 US disclosed
US-20120061651-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-03-15 US disclosed
US-20120061651-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-03-15 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 (1 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-20120061651-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device CYP2J2, CYP1A1, CRY1 ALDH1A1 42/4885HSD17B10 900/4885TSHR 2660/4885

“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.