SCHEMBL28501050

SCHEMBL28501050

O=C(Cl)c1ccc2c(oc3ccccc32)c1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.40
MAOA P21397 3/20 0.40
PTGS2 P35354 1/20 0.39
AHR P35869 3/20 0.38
HSD17B10 Q99714 2/20 0.38
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
TTR P02766 2/20 0.37
KDM5A P29375 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
DYRK1A Q13627 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
CDC14B O60729 1/20 0.35

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
SCHEMBL4586057 0.80 ALOX5 (0.48) ALOX5MAOAPTGS2AHRHSD17B10
SCHEMBL29706088 0.75 PTGS2 (0.51) ALOX5MAOAPTGS2HSD17B10MEN1
SCHEMBL30008096 0.75 AHR (0.51) ALOX5MAOAPTGS2AHRHSD17B10
SCHEMBL22883938 0.75 AHR (0.51) ALOX5MAOAPTGS2AHRHSD17B10
SCHEMBL29897734 0.74 AHR (0.42) ALOX5MAOAPTGS2AHRHSD17B10
SCHEMBL25611875 0.74 AHR (0.42) ALOX5MAOAPTGS2AHRHSD17B10
SCHEMBL11430498 0.74 PTGS2 (0.51) ALOX5MAOAPTGS2HSD17B10MEN1
SCHEMBL29240324 0.71 AHR (0.40) ALOX5MAOAPTGS2AHRHSD17B10
SCHEMBL20321533 0.71 AHR (0.43) ALOX5MAOAPTGS2AHRHSD17B10
SCHEMBL7982441 0.71 KDM4E (0.46) ALOX5PTGS2HSD17B10MEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112175016-B Organic electrophosphorescent luminescent material and application thereof 北京燕化集联光电技术有限公司 2022-11-11 CN disclosed
CN-112321647-B Iridium complex containing benzimidazole structure and application thereof 北京燕化集联光电技术有限公司 2022-08-16 CN disclosed
CN-112341499-B Sulfur-containing organic electrophosphorescent luminescent material and application thereof 北京燕化集联光电技术有限公司 2022-07-12 CN disclosed
CN-112209973-B Oxygen-containing organic electrophosphorescent material and application thereof 北京燕化集联光电技术有限公司 2022-06-24 CN disclosed
CN-112175017-B Organic electrophosphorescent material and application thereof 北京燕化集联光电技术有限公司 2022-06-14 CN disclosed
CN-112341499-A Sulfur-containing organic electrophosphorescent luminescent material and application thereof 北京燕化集联光电技术有限公司 2021-02-09 CN disclosed
CN-112321647-A Iridium complex containing benzimidazole structure and application thereof 北京燕化集联光电技术有限公司 2021-02-05 CN disclosed
CN-112209973-A O-containing organic electrophosphorescent material and application thereof 北京燕化集联光电技术有限公司 2021-01-12 CN disclosed
CN-112175016-A Organic electrophosphorescent luminescent material and application thereof 北京燕化集联光电技术有限公司 2021-01-05 CN disclosed
CN-112175017-A Organic electrophosphorescent material and application thereof 北京燕化集联光电技术有限公司 2021-01-05 CN disclosed