SCHEMBL503617

SCHEMBL503617

c1ccc2c(c1)c1cccc3c4cc5c(cc4cc2c31)c1cccc2cccc5c21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.56
HSD17B10 Q99714 8/20 0.56
CYP1A2 P05177 6/20 0.56
HPGD P15428 5/20 0.56
THRB P10828 1/20 0.56
ERBB2 P04626 1/20 0.45
FYN P06241 1/20 0.45
MAOA P21397 1/20 0.45
ACHE P22303 1/20 0.45
AHR P35869 1/20 0.45
HIF1A Q16665 3/20 0.44
CYP1B1 Q16678 2/20 0.44
TSHR P16473 5/20 0.41
MAPK1 P28482 3/20 0.41
CASP1 P29466 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HPRT1 P00492 3/20 0.37
TP53 P04637 1/20 0.37
CASP7 P55210 1/20 0.37
CYP1A1 P04798 1/20 0.36

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
SCHEMBL5469879 0.98 ALDH1A1 (0.54) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL2298145 0.92 ALDH1A1 (0.58) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL2585346 0.91 ALDH1A1 (0.56) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4851988 0.89 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL1978902 0.89 ALDH1A1 (0.58) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL7128292 0.89 ALDH1A1 (0.64) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4851543 0.85 ALDH1A1 (0.60) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL5471597 0.85 ALDH1A1 (0.54) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL11314893 0.84 ALDH1A1 (0.58) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4846679 0.84 CYP1A2 (0.61) ALDH1A1HSD17B10CYP1A2HPGDTHRB

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9315460-B2 Organic compound, light-emitting device, and image display apparatus CANON KABUSHIKI KAISHA (JP) 2016-04-19 US claimed
EP-2421809-B1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KK (JP) 2015-09-02 EP claimed
US-8940413-B2 Organic compound having acenaphtho[1,2-k]benzo[e]acephenanthrene derivative, light-emitting device, and image display apparatus CANON KABUSHIKI KAISHA (JP) 2015-01-27 US claimed
US-20140374738-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KK (JP) 2014-12-25 US claimed
US-8293384-B2 Organic compound, light-emitting device, and image display apparatus CANON KABUSHIKI KAISHA (JP) 2012-10-23 US claimed
EP-2243761-B1 Phenanthrene derivatives, light-emitting device and image display apparatus using the same CANON KK (JP) 2012-08-22 EP claimed
US-20120025183-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2012-02-02 US claimed
US-20100270914-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2010-10-28 US claimed
EP-2243761-A1 Phenanthrene derivatives, light-emitting device and image display apparatus using the same Canon Kabushiki Kaisha (JP) 2010-10-27 EP claimed
US-20260150491-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2026-05-28 US disclosed
EP-4750286-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT Canon Kabushiki Kaisha (JP) 2026-05-27 EP disclosed
US-11271164-B2 Compound, composition, organic electroluminescent element and electronic device IDEMITSU KOSAN CO., LTD (JP) 2022-03-08 US disclosed
US-20210139417-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2021-05-13 US disclosed
US-20200358000-A1 COMPOUND, COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-11-12 US disclosed
US-20100270914-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2010-10-28 US disclosed
US-20100270914-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2010-10-28 US disclosed
WO-2010123153-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2010-10-28 WO disclosed
EP-2243761-A1 Phenanthrene derivatives, light-emitting device and image display apparatus using the same Canon Kabushiki Kaisha (JP) 2010-10-27 EP disclosed
EP-2243761-A1 Phenanthrene derivatives, light-emitting device and image display apparatus using the same Canon Kabushiki Kaisha (JP) 2010-10-27 EP disclosed
CN-101870705-A Novel organic compound, light-emitting device, and image display apparatus CANON KK 2010-10-27 CN 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 (6 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-20200358000-A1 COMPOUND, COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE PAX2, CXXC4, XDH ALDH1A1 4357/4885HSD17B10 2792/4885CYP1A2 488/4885
US-20260150491-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT NR2E3, RORB, RORA ALDH1A1 256/4885HSD17B10 2628/4885CYP1A2 377/4885
US-20120025183-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS ACE, ACE2, AGTR1 ALDH1A1 218/4885HSD17B10 474/4885CYP1A2 182/4885
US-20210139417-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CYP1A1, POU2F1, NFE2L2 ALDH1A1 252/4885HSD17B10 2314/4885CYP1A2 33/4885
US-11271164-B2 Compound, composition, organic electroluminescent element and electronic device PAX2, CXXC4, XDH ALDH1A1 4357/4885HSD17B10 2792/4885CYP1A2 488/4885
US-20100270914-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS ACE2, ACE, AGTR1 ALDH1A1 100/4885HSD17B10 475/4885CYP1A2 50/4885

“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.