SCHEMBL12456703

SCHEMBL12456703

c1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4cccc(-c5cccc(-c6cccc(-c7cc(-c8cc(-n9c%10ccccc%10c%10c9ccc9c%11ccccc%11n(-c%11ccccc%11)c9%10)cc(-n9c%10ccccc%10c%10c9ccc9c%11ccccc%11n(-c%11ccccc%11)c9%10)c8)cc(-n8c9ccccc9c9ccc%10c(c%11ccccc%11n%10-c%10ccccc%10)c98)c7)c6)c5)c4)c23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
ATM Q13315 2/20 0.46
KDM4E B2RXH2 2/20 0.46
KMT2A Q03164 4/20 0.35
IL1R1 P14778 1/20 0.35
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 3/20 0.34
HTT P42858 2/20 0.34
MAPT P10636 1/20 0.34
JAK2 O60674 1/20 0.33
JAK3 P52333 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
BRCA1 P38398 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GAA P10253 1/20 0.32
RXFP1 Q9HBX9 1/20 0.31
PKM P14618 2/20 0.31
FAAH O00519 1/20 0.31
HSP90AA1 P07900 1/20 0.31

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
SCHEMBL12456696 0.99 L3MBTL1 (0.47) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL12456514 0.96 L3MBTL1 (0.45) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL12456565 0.96 L3MBTL1 (0.45) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL12456564 0.96 L3MBTL1 (0.47) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL26146592 0.96 ATM (0.44) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL24837268 0.96 L3MBTL1 (0.47) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL26472703 0.96 ATM (0.44) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL24677186 0.96 ATM (0.44) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL12691260 0.96 L3MBTL1 (0.50) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL10059913 0.96 L3MBTL1 (0.50) L3MBTL1ATMKDM4EKMT2AIL1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3176241-A1 ORGANIC LIGHT-EMITTING MATERIAL AND ORGANIC LIGHT-EMITTING ELEMENT Nippon Steel & Sumikin Chemical Co., Ltd. (JP) 2017-06-07 EP disclosed
US-9260433-B2 Organic electroluminescent device NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2016-02-16 US disclosed
US-9260433-B2 Organic electroluminescent device NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2016-02-16 US disclosed
US-20150166886-A1 FLUORESCENCE AND DELAYED FLUORESCENCE-TYPE ORGANIC LIGHT-EMITTING MATERIAL AND ELEMENT KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2015-06-18 US disclosed
US-20150166886-A1 FLUORESCENCE AND DELAYED FLUORESCENCE-TYPE ORGANIC LIGHT-EMITTING MATERIAL AND ELEMENT KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2015-06-18 US disclosed
US-8993129-B2 Fluorescence and delayed fluorescence-type organic light-emitting material and element NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2015-03-31 US disclosed
US-8993129-B2 Fluorescence and delayed fluorescence-type organic light-emitting material and element NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2015-03-31 US disclosed
US-20120241732-A1 ORGANIC LIGHT-EMITTING MATERIAL AND ORGANIC LIGHT-EMITTING ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2012-09-27 US disclosed
US-20120241732-A1 ORGANIC LIGHT-EMITTING MATERIAL AND ORGANIC LIGHT-EMITTING ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2012-09-27 US disclosed
US-20120235133-A1 ORGANIC ELECTROLUMINESCENT DEVICE NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2012-09-20 US disclosed
US-20120235133-A1 ORGANIC ELECTROLUMINESCENT DEVICE NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2012-09-20 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 (1 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-20150166886-A1 FLUORESCENCE AND DELAYED FLUORESCENCE-TYPE ORGANIC LIGHT-EMITTING MATERIAL AND ELEMENT LEF1, EML4, TEAD1 L3MBTL1 155/4885ATM 2146/4885KDM4E 2765/4885

“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.