SCHEMBL2597529

SCHEMBL2597529

Brc1ccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
MAPK1 P28482 1/20 0.52
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
NLRP3 Q96P20 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HDAC4 P56524 1/20 0.39
NR3C1 P04150 1/20 0.37
MDM2 Q00987 2/20 0.36
TSPO P30536 1/20 0.36
FEN1 P39748 1/20 0.36

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
SCHEMBL30045167 1.00 ALDH1A1 (0.52) ALDH1A1MAPK1KDM4EATML3MBTL1
SCHEMBL31122338 1.00 ALDH1A1 (0.52) ALDH1A1MAPK1KDM4EATML3MBTL1
SCHEMBL17742564 1.00 ALDH1A1 (0.52) ALDH1A1MAPK1KDM4EATML3MBTL1
SCHEMBL3388459 0.97 ALDH1A1 (0.52) ALDH1A1MAPK1KDM4EATML3MBTL1
SCHEMBL14183853 0.95 L3MBTL1 (0.52) ALDH1A1MAPK1KDM4EATML3MBTL1
SCHEMBL16586062 0.95 L3MBTL1 (0.52) ALDH1A1MAPK1KDM4EATML3MBTL1
SCHEMBL29842207 0.95 L3MBTL1 (0.52) ALDH1A1MAPK1KDM4EATML3MBTL1
SCHEMBL30392255 0.95 L3MBTL1 (0.52) ALDH1A1MAPK1KDM4EATML3MBTL1
SCHEMBL1714103 0.95 L3MBTL1 (0.52) ALDH1A1MAPK1KDM4EATML3MBTL1
SCHEMBL16356738 0.95 L3MBTL1 (0.52) ALDH1A1MAPK1KDM4EATML3MBTL1

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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295490-A1 LIGHT-EMITTING NANOPARTICLES AND LIGHT-EMITTING LABELING MATERIAL FOR PATHOLOGICAL DIAGNOSIS Konica Minolta, Inc. (JP) 2023-09-21 US disclosed
US-20230295490-A1 LIGHT-EMITTING NANOPARTICLES AND LIGHT-EMITTING LABELING MATERIAL FOR PATHOLOGICAL DIAGNOSIS Konica Minolta, Inc. (JP) 2023-09-21 US disclosed
WO-2023170880-A1 DICARBAZOLYL BENZENE COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE 国立大学法人京都大学 2023-09-14 WO disclosed
WO-2023171761-A1 DICARBAZOLYL COMPOUND AND ORGANIC ELECTROLUMINESCENCE ELEMENT 国立大学法人京都大学 2023-09-14 WO disclosed
WO-2023171761-A1 DICARBAZOLYL COMPOUND AND ORGANIC ELECTROLUMINESCENCE ELEMENT 国立大学法人京都大学 2023-09-14 WO disclosed
WO-2023170880-A1 DICARBAZOLYL BENZENE COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE 国立大学法人京都大学 2023-09-14 WO disclosed
CN-110156611-B Phenyl branched luminescent material and organic electroluminescent device thereof 武汉尚赛光电科技有限公司 2022-11-11 CN disclosed
WO-2021261398-A1 LIGHT-EMITTING NANOPARTICLES AND LIGHT-EMITTING LABELING MATERIAL FOR PATHOLOGICAL DIAGNOSIS コニカミノルタ株式会社 2021-12-30 WO disclosed
US-20210070717-A1 ORGANIC COMPOUND BASED ON TRIAZINE AND BENZOXAZOLE AND APPLICATION THEREOF IN ORGANIC ELECTROLUMINESCENT DEVICE JIANGSU SUNERA TECHNOLOGY CO., LTD. (CN) 2021-03-11 US disclosed
WO-2020138945-A1 COMPOUND, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 엘티소재주식회사 2020-07-02 WO disclosed
US-20120012830-A1 MATERIAL FOR ORGANIC PHOTOELECTRIC DEVICE, AND ORGANIC PHOTOELECTRIC DEVICE THEREBY CHEIL INDUSTRIES, INC. (KR) 2012-01-19 US disclosed
US-20120012830-A1 MATERIAL FOR ORGANIC PHOTOELECTRIC DEVICE, AND ORGANIC PHOTOELECTRIC DEVICE THEREBY CHEIL INDUSTRIES, INC. (KR) 2012-01-19 US disclosed
WO-2011145876-A2 NOVEL HYBRID ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2011-11-24 WO disclosed
US-20100213826-A1 Material for organic photoelectric device, and organic photoelectric device thereby CHEIL INDUSTRIES, INC. (KR) 2010-08-26 US disclosed
US-20100213826-A1 Material for organic photoelectric device, and organic photoelectric device thereby CHEIL INDUSTRIES, INC. (KR) 2010-08-26 US disclosed
EP-2169028-A2 Material for organic electroluminescent devices and organic electroluminescent devices made by using the same Idemitsu Kosan Co., Ltd. (JP) 2010-03-31 EP disclosed
EP-2169028-A2 Material for organic electroluminescent devices and organic electroluminescent devices made by using the same Idemitsu Kosan Co., Ltd. (JP) 2010-03-31 EP disclosed
US-20050249976-A1 Material for organic electroluminescence devices and organic electroluminescence device using the material IDEMITSU KOSAN CO., LTD. (JP) 2005-11-10 US disclosed
EP-1489155-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICES AND ORGANIC ELECTROLUMINESCENT DEVICES MADE BY USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2004-12-22 EP disclosed
US-20040086745-A1 Material for organic electroluminescence devices and organic electroluminescence device using the material IDEMITSU KOSAN CO., LTD. (JP) 2004-05-06 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 (3 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-20100213826-A1 Material for organic photoelectric device, and organic photoelectric device thereby HCN1, HCN2, HCN4 ALDH1A1 349/4885MAPK1 533/4885KDM4E 4279/4885
US-20210070717-A1 ORGANIC COMPOUND BASED ON TRIAZINE AND BENZOXAZOLE AND APPLICATION THEREOF IN ORGANIC ELECTROLUMINESCENT DEVICE OCIAD1, EED, OCIAD2 ALDH1A1 1116/4885MAPK1 4260/4885KDM4E 1651/4885
US-20120012830-A1 MATERIAL FOR ORGANIC PHOTOELECTRIC DEVICE, AND ORGANIC PHOTOELECTRIC DEVICE THEREBY HCN1, HCN2, HCN4 ALDH1A1 349/4885MAPK1 533/4885KDM4E 4279/4885

“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.