SCHEMBL3563744

SCHEMBL3563744

Cc1ccccc1-c1ccccc1Br

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.62
MAPK1 P28482 2/20 0.50
MAOB P27338 3/20 0.47
MAOA P21397 2/20 0.47
TSHR P16473 2/20 0.45
ACHE P22303 1/20 0.45
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
HSD11B1 P28845 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
BRD4 O60885 1/20 0.39
HTR7 P34969 1/20 0.38

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
SCHEMBL29135448 0.83 ALDH1A1 (0.54) ALDH1A1MAPK1MAOBMAOATSHR
SCHEMBL30340814 0.83 ALDH1A1 (0.54) ALDH1A1MAPK1MAOBMAOATSHR
SCHEMBL8210892 0.83 ALDH1A1 (0.54) ALDH1A1MAPK1MAOBMAOATSHR
SCHEMBL197690 0.83 ACHE (0.64) ALDH1A1TSHRACHENPC1RAB9A
SCHEMBL30354037 0.83 ACHE (0.64) ALDH1A1TSHRACHENPC1RAB9A
SCHEMBL30169568 0.83 ACHE (0.64) ALDH1A1TSHRACHENPC1RAB9A
SCHEMBL31295703 0.83 ALDH1A1 (0.67) ALDH1A1MAPK1MAOBMAOATSHR
SCHEMBL358976 0.83 ALDH1A1 (0.67) ALDH1A1MAPK1MAOBMAOATSHR
SCHEMBL28888551 0.81 ALDH1A1 (0.52) ALDH1A1MAPK1MAOBMAOATSHR
SCHEMBL13319611 0.80 ALDH1A1 (0.50) ALDH1A1MAPK1MAOBMAOATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119798334-A Four-subgroup metal complex containing benzylamino side arm biphenyl Shan Maodi, and preparation method and application thereof 北京旭阳科技有限公司 2025-04-11 CN disclosed
US-20230189630-A1 LIGHT EMITTING ELEMENT AND ORGANOMETALLIC COMPOUND FOR LIGHT EMITTING ELEMENT SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-15 US disclosed
US-20230167145-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-06-01 US disclosed
CN-111807977-B 9-aniline fluorene-9-carboxylic ester compound and preparation method thereof 武汉理工大学 2022-11-04 CN disclosed
WO-2022213794-A1 ORGANIC COMPOUND, ELECTRONIC ELEMENT COMPRISING SAME, AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 2022-10-13 WO disclosed
WO-2022191488-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-09-15 WO disclosed
WO-2021107474-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 엘티소재주식회사 2021-06-03 WO disclosed
WO-2020218680-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DIODE USING SAME 두산솔루스 주식회사 2020-10-29 WO disclosed
CN-111807977-A 9-aniline fluorene-9-carboxylic ester compound and preparation method thereof 武汉理工大学 2020-10-23 CN disclosed
EP-2838930-B1 POLYMERS CONTAINING SUBSTITUTED OLIGO-TRIARYLAMINE UNITS AND ELECTROLUMINESCENCE DEVICES CONTAINING SUCH POLYMERS MERCK PATENT GMBH (DE) 2020-10-14 EP disclosed
CN-1922930-A Organic electronic devices MERCK PATENT GMBH (DE) 2007-02-28 CN disclosed
EP-1716724-A1 ORGANIC ELECTRONIC DEVICES Covion Organic Semiconductors GmbH (DE) 2006-11-02 EP disclosed
EP-1097158-B1 LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES MASSACHUSETTS INST TECHNOLOGY (US) 2006-01-25 EP disclosed
WO-2005084081-A1 ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2005-09-09 WO disclosed
US-6686495-B2 IN PRESENCE OF PALLADIUM CATALYST; USEFUL IN PRODUCING CHEMICAL INTERMEDIATES FOR PHARMACEUTICALS, OPTICAL BRIGHTENING AGENTS AND AGROCHEMICALS OMG AG & CO KG (DE) 2004-02-03 US disclosed
EP-1354887-A1 Ligands for metals and improved metal-catalyzed processes based thereon Massachusetts Insitute of Technology (US) 2003-10-22 EP disclosed
US-20020107426-A1 Process for the preparation of mono-, bi- or poly- functional biaryls UMICORE AG & CO. KG (DE) 2002-08-08 US disclosed
EP-1199292-A1 Process for the production of mono-, bi- or polyfunctional biaryls OMG AG & Co. KG (DE) 2002-04-24 EP disclosed
EP-1097158-A2 LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2001-05-09 EP disclosed
WO-2000002887-A2 LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2000-01-20 WO 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-20230189630-A1 LIGHT EMITTING ELEMENT AND ORGANOMETALLIC COMPOUND FOR LIGHT EMITTING ELEMENT NFE2L2, CRY1, LEF1 ALDH1A1 75/4885MAPK1 1008/4885MAOB 3776/4885
US-20230167145-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OSBP ALDH1A1 263/4885MAPK1 4082/4885MAOB 604/4885
US-20020107426-A1 Process for the preparation of mono-, bi- or poly- functional biaryls CYP4F3, CYP4F2, CYP2F1 ALDH1A1 714/4885MAPK1 3266/4885MAOB 33/4885

“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.