SCHEMBL21116803

SCHEMBL21116803

c1ccc(-n2c3ccccc3c3c2c(-c2ccc(-c4cccc5c4sc4ccccc45)cc2)cc2c4ccccc4n(-c4ccccc4)c23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PRKDC P78527 3/20 0.36
▸ PARP14 Q460N5 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ PIK3CB P42338 1/20 0.32
▸ MTOR P42345 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ BRDT Q58F21 1/20 0.32
▸ TP53 P04637 1/20 0.31
▸ TNKS O95271 1/20 0.30
▸ TNKS2 Q9H2K2 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
SCHEMBL17228921 0.86 ALOX5 (0.46) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL21578528 0.86 ATM (0.39) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL21116841 0.86 ALOX5 (0.44) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505202 0.86 ALOX5 (0.42) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL15759599 0.86 ALOX5 (0.42) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL21941600 0.85 ATM (0.40) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL12175755 0.85 ALOX5 (0.47) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505253 0.85 ALOX5 (0.41) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505225 0.85 ALOX5 (0.41) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL12286281 0.85 ALOX5 (0.49) ALOX5KDM4EATML3MBTL1PRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11844271-B2 Organic compound, composition, organic optoelectronic device, and display apparatus SAMSUNG SDI CO., LTD. (KR) 2023-12-12 — — US disclosed
US-11844271-B2 Organic compound, composition, organic optoelectronic device, and display apparatus SAMSUNG SDI CO., LTD. (KR) 2023-12-12 — — US disclosed
US-20230389420-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2023-11-30 — — US disclosed
US-20230389420-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2023-11-30 — — US disclosed
US-20230371371-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2023-11-16 — — US disclosed
US-20230371371-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2023-11-16 — — US disclosed
US-11723270-B2 Organic optoelectronic diode and display device SAMSUNG SDI CO., LTD. (KR) 2023-08-08 — — US disclosed
US-11723270-B2 Organic optoelectronic diode and display device SAMSUNG SDI CO., LTD. (KR) 2023-08-08 — — US disclosed
US-11158817-B2 Compound for organic optoelectronic device, composition for organic optoelectronic device and organic optoelectronic device and display device SAMSUNG SDI CO., LTD. (KR) 2021-10-26 — — US disclosed
US-20200388766-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DIODE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-12-10 — — US disclosed
US-20200388765-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY APPARATUS SAMSUNG SDI CO., LTD. (KR) 2020-12-10 — — US disclosed
US-20200161563-A1 ORGANIC OPTOELECTRONIC DIODE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-05-21 — — US disclosed
US-20200161564-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-05-21 — — US disclosed
US-20190198780-A1 ORGANIC COMPOUND AND COMPOSITION AND ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-06-27 — — US disclosed
US-20190181351-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC ELEMENT, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2019-06-13 — — 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 (11 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-20230371371-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OCIAD1, OXER1, OR10J3 ALOX5 313/4885KDM4E 4286/4885ATM 4264/4885
US-20200388765-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY APPARATUS OCIAD1, OXER1, OR10J3 ALOX5 402/4885KDM4E 4321/4885ATM 4140/4885
US-20200388766-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DIODE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE AND DISPLAY DEVICE OCIAD2, OR10J3, OCIAD1 ALOX5 372/4885KDM4E 3500/4885ATM 3143/4885
US-11723270-B2 Organic optoelectronic diode and display device ITGB4, OR10J3, EPB41 ALOX5 1379/4885KDM4E 1727/4885ATM 4046/4885
US-20190181351-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC ELEMENT, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE OCIAD2, OCIAD1, OR10J3 ALOX5 383/4885KDM4E 4011/4885ATM 3531/4885
US-11158817-B2 Compound for organic optoelectronic device, composition for organic optoelectronic device and organic optoelectronic device and display device OXER1, OCIAD1, OR10J3 ALOX5 260/4885KDM4E 4045/4885ATM 3547/4885
US-20200161564-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OXER1, OR10J3, OCIAD1 ALOX5 802/4885KDM4E 4066/4885ATM 3422/4885
US-20230389420-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE ITGB4, OR10J3, EPB41 ALOX5 1466/4885KDM4E 1807/4885ATM 4111/4885
US-11844271-B2 Organic compound, composition, organic optoelectronic device, and display apparatus OCIAD1, OXER1, OR10J3 ALOX5 402/4885KDM4E 4321/4885ATM 4140/4885
US-20190198780-A1 ORGANIC COMPOUND AND COMPOSITION AND ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE OR10J3, OXER1, OR51E2 ALOX5 1427/4885KDM4E 4194/4885ATM 3358/4885
US-20200161563-A1 ORGANIC OPTOELECTRONIC DIODE AND DISPLAY DEVICE ITGB4, OR10J3, EPB41 ALOX5 1379/4885KDM4E 1727/4885ATM 4046/4885

“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.

Send feedback