SCHEMBL22707478

SCHEMBL22707478

c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5cccc6c5sc5c7ccccc7ccc65)c5ccccc45)cc3)ccc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 6/20 0.42
CYP1B1 Q16678 6/20 0.42
CYP1A2 P05177 3/20 0.41
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
PIM1 P11309 2/20 0.36
ALOX5 P09917 2/20 0.35
GSTP1 P09211 1/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
CA12 O43570 1/20 0.35
SOS1 Q07889 1/20 0.35
S1PR4 O95977 1/20 0.34
S1PR5 Q9H228 1/20 0.34

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
SCHEMBL17944684 0.94 CYP1A1 (0.43) CYP1A1CYP1B1CYP1A2HSD17B1HSD17B2
SCHEMBL17945304 0.93 CYP1A1 (0.44) CYP1A1CYP1B1CYP1A2ESR1ESR2
SCHEMBL27301888 0.93 CYP1A1 (0.41) CYP1A1CYP1B1CYP1A2HDAC4HDAC2
SCHEMBL17944348 0.93 CYP1A1 (0.47) CYP1A1CYP1B1CYP1A2ESR1ESR2
SCHEMBL26003233 0.93 CYP1A1 (0.40) CYP1A1CYP1B1CYP1A2ESR1ESR2
SCHEMBL17944822 0.90 CYP1A1 (0.43) CYP1A1CYP1B1CYP1A2HSD17B1HSD17B2
SCHEMBL19080260 0.90 CYP1A1 (0.43) CYP1A1CYP1B1CYP1A2ESR1ESR2
SCHEMBL17945223 0.90 CYP1A1 (0.48) CYP1A1CYP1B1CYP1A2ESR1ESR2
SCHEMBL19080291 0.89 CYP1B1 (0.42) CYP1A1CYP1B1CYP1A2ESR1ESR2
SCHEMBL17932040 0.88 CYP1A1 (0.41) CYP1A1CYP1B1CYP1A2HSD17B1HSD17B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4265624-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME Lg Chem, Ltd. (KR) 2023-10-25 EP disclosed
US-11780856-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2023-10-10 US disclosed
US-11780856-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2023-10-10 US disclosed
US-20230320214-A1 ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANIC COMPOUND LG CHEM, LTD. (KR) 2023-10-05 US disclosed
US-20230320214-A1 ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANIC COMPOUND LG CHEM, LTD. (KR) 2023-10-05 US disclosed
WO-2023172110-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-09-14 WO disclosed
WO-2023172111-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-09-14 WO disclosed
WO-2023136476-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2023-07-20 WO disclosed
US-11685751-B2 Compound and organic light-emitting element comprising same LG CHEM, LTD. (KR) 2023-06-27 US disclosed
US-20230061019-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2023-03-02 US disclosed
US-20230002420-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2023-01-05 US disclosed
US-20220399501-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2022-12-15 US disclosed
WO-2022139513-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-06-30 WO disclosed
US-20220153758-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2022-05-19 US disclosed
WO-2022103090-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-05-19 WO disclosed
US-20210391547-A1 BORON-CONTAINING COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2021-12-16 US disclosed
WO-2021107681-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-06-03 WO disclosed
WO-2021107680-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-06-03 WO disclosed
WO-2021020929-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-02-04 WO disclosed
US-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 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 (8 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-20230002420-A1 ORGANIC LIGHT-EMITTING ELEMENT CYBA, CRY1, CYP1A1 CYP1A1 3/4885CYP1B1 7/4885CYP1A2 25/4885
US-20220399501-A1 ORGANIC LIGHT-EMITTING ELEMENT CYP1A1, AHR, CYP1B1 CYP1A1 1/4885CYP1B1 3/4885CYP1A2 10/4885
US-20230061019-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, LEF1 CYP1A1 7/4885CYP1B1 20/4885CYP1A2 47/4885
US-20220153758-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME CCNY, CDYL, NR1H2 CYP1A1 217/4885CYP1B1 420/4885CYP1A2 361/4885
US-20230320214-A1 ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANIC COMPOUND CYP1A1, AOX1, CYP1B1 CYP1A1 1/4885CYP1B1 3/4885CYP1A2 12/4885
US-11780856-B2 Compound and organic light-emitting device comprising same CRY1, CRY2, LEF1 CYP1A1 4/4885CYP1B1 5/4885CYP1A2 24/4885
US-20210391547-A1 BORON-CONTAINING COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME CRY1, POU2F1, LEF1 CYP1A1 56/4885CYP1B1 21/4885CYP1A2 350/4885
US-11685751-B2 Compound and organic light-emitting element comprising same CRY1, CRY2, LEF1 CYP1A1 7/4885CYP1B1 20/4885CYP1A2 47/4885

“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.