SCHEMBL16675648

SCHEMBL16675648

c1ccc(-c2ccc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccc7c8ccccc8oc7c65)ccc43)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HDAC4 P56524 1/20 0.35
ALOX5 P09917 1/20 0.34
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
ALDH1A1 P00352 5/20 0.33
PPARG P37231 3/20 0.33
RXFP1 Q9HBX9 3/20 0.33
NR2E3 Q9Y5X4 3/20 0.33
NCOR2 Q9Y618 3/20 0.33
PLA2G2A P14555 2/20 0.32
PLA2G4A P47712 2/20 0.32
POLB P06746 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
RAC2 P15153 1/20 0.32
RAC3 P60763 1/20 0.32
CDC42 P60953 1/20 0.32

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
SCHEMBL24675346 0.98 KDM4E (0.38) KDM4EATML3MBTL1HDAC4ALOX5
SCHEMBL19653560 0.95 KDM4E (0.40) KDM4EATML3MBTL1HDAC4ALOX5
SCHEMBL24675402 0.95 KDM4E (0.40) KDM4EATML3MBTL1HDAC4ALOX5
SCHEMBL24174745 0.95 KDM4E (0.40) KDM4EATML3MBTL1HDAC4ALOX5
SCHEMBL24174206 0.95 KDM4E (0.40) KDM4EATML3MBTL1HDAC4ALOX5
SCHEMBL24173632 0.95 KDM4E (0.40) KDM4EATML3MBTL1HDAC4ALOX5
SCHEMBL15583120 0.94 KDM4E (0.40) KDM4EATML3MBTL1HDAC4ALOX5
SCHEMBL19653544 0.94 KDM4E (0.42) KDM4EATML3MBTL1HDAC4ALOX5
SCHEMBL17759471 0.94 KDM4E (0.42) KDM4EATML3MBTL1HDAC4ALOX5
SCHEMBL15583147 0.94 KDM4E (0.46) KDM4EATML3MBTL1ALOX5ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10580997-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-03-03 US disclosed
US-20190157603-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-05-23 US disclosed
US-20170352819-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-12-07 US disclosed
US-20170352819-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-12-07 US disclosed
US-20150115205-A1 NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE CONTAINING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-04-30 US disclosed
US-20150115205-A1 NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE CONTAINING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-04-30 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 (2 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-10580997-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CCNA1, CCNE2 KDM4E 3973/4885ATM 686/4885L3MBTL1 1118/4885
US-20170352819-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNA1, CCNE2 KDM4E 3973/4885ATM 686/4885L3MBTL1 1118/4885

“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.