SCHEMBL20210403

SCHEMBL20210403

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4[nH]c5ccccc5c4c3)n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.52
ALDH1A1 P00352 5/20 0.48
HSD17B10 Q99714 3/20 0.48
GPR3 P46089 1/20 0.48
TOP2A P11388 1/20 0.46
HPGD P15428 4/20 0.45
KIF11 P52732 3/20 0.45
KMT2A Q03164 3/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 2/20 0.45
MAPT P10636 2/20 0.45
GABRP O00591 3/20 0.44
GABRD O14764 3/20 0.44
GABRA1 P14867 3/20 0.44
GABRB1 P18505 3/20 0.44
GABRG2 P18507 3/20 0.44
GABRB3 P28472 3/20 0.44
GABRA5 P31644 3/20 0.44
GABRA3 P34903 3/20 0.44
GABRA2 P47869 3/20 0.44

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
SCHEMBL29513071 1.00 AHR (0.52) AHRALDH1A1HSD17B10GPR3TOP2A
SCHEMBL15786396 0.95 AHR (0.47) AHRALDH1A1HSD17B10GPR3TOP2A
SCHEMBL16809116 0.95 AHR (0.50) AHRALDH1A1HSD17B10GPR3TOP2A
SCHEMBL21320501 0.94 AHR (0.46) AHRALDH1A1HSD17B10GPR3TOP2A
SCHEMBL21375361 0.90 ALDH1A1 (0.49) AHRALDH1A1HSD17B10GPR3HPGD
SCHEMBL17714956 0.90 AHR (0.52) AHRALDH1A1HSD17B10GPR3TOP2A
SCHEMBL17714784 0.87 TDO2 (0.43) AHRALDH1A1HSD17B10GPR3TOP2A
SCHEMBL17714862 0.87 MEN1 (0.50) AHRALDH1A1HSD17B10GPR3TOP2A
SCHEMBL15786376 0.87 MEN1 (0.50) AHRALDH1A1HSD17B10GPR3TOP2A
SCHEMBL17714926 0.87 TOP2A (0.43) AHRALDH1A1HSD17B10GPR3TOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230403931-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2023-12-14 US disclosed
CN-113214202-B Heterocyclic compound and organic light emitting diode comprising the same 株式会社LG化学 2023-11-21 CN disclosed
CN-116323615-A Organic molecules for optoelectronic devices 三星显示有限公司 2023-06-23 CN disclosed
US-11600783-B2 Organic molecules for use in optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-03-07 US disclosed
US-11575088-B2 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2023-02-07 US disclosed
EP-3617290-B1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-03-09 EP disclosed
US-11211567-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2021-12-28 US disclosed
US-11201297-B2 Organic electroluminescence device and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2021-12-14 US disclosed
CN-113214202-A Heterocyclic compound and organic light emitting diode including the same 株式会社LG化学 2021-08-06 CN disclosed
EP-3617201-B1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2021-08-04 EP disclosed
EP-3617201-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-03-04 EP disclosed
EP-3617290-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-03-04 EP disclosed
US-20190288221-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2019-09-19 US disclosed
EP-3530659-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-08-28 EP disclosed
US-20190198777-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES KYULUX, INC. (JP) 2019-06-27 US disclosed
US-20190198774-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-06-27 US disclosed
WO-2019038448-A1 ORGANIC TRIAZINE CONTAINING MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-02-28 WO disclosed
EP-3431473-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-01-23 EP disclosed
US-20190019960-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-01-17 US disclosed
EP-3330262-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE CONTAINING SAME LG Chem, Ltd. (KR) 2018-06-06 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 (7 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-20190198774-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, TRPC1, PER2 AHR 801/4885ALDH1A1 176/4885HSD17B10 2288/4885
US-11600783-B2 Organic molecules for use in optoelectronic devices OR10J3, OR51E2, ALDH1A2 AHR 3195/4885ALDH1A1 48/4885HSD17B10 2936/4885
US-11575088-B2 Composition of matter for use in organic light-emitting diodes CRY2, CYBA, ALDH1A2 AHR 668/4885ALDH1A1 116/4885HSD17B10 2982/4885
US-20190019960-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, ORC3 AHR 3183/4885ALDH1A1 981/4885HSD17B10 3512/4885
US-11211567-B2 Heterocyclic compound and organic light-emitting device including the same CRY1, TRPC1, PER2 AHR 801/4885ALDH1A1 176/4885HSD17B10 2288/4885
US-20230403931-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES OR10J3, EPCAM, CYBA AHR 2586/4885ALDH1A1 47/4885HSD17B10 3263/4885
US-20190198777-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES CRY2, CYBA, ALDH1A2 AHR 668/4885ALDH1A1 116/4885HSD17B10 2982/4885

“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.