SCHEMBL5604869

SCHEMBL5604869

Cc1cc(C)cc(N(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
MAPT P10636 4/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
TDP1 Q9NUW8 2/20 0.52
CYP2C19 P33261 2/20 0.52
KDM4E B2RXH2 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
TSPO P30536 1/20 0.43
TSHR P16473 3/20 0.41
ACHE P22303 2/20 0.41
LMNA P02545 1/20 0.41
ALOX12 P18054 1/20 0.41
APP P05067 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
CRHBP P24387 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL15306317 1.00 ALDH1A1 (0.52) ALDH1A1MAPTL3MBTL1TDP1CYP2C19
SCHEMBL9163755 0.98 ALDH1A1 (0.56) ALDH1A1MAPTL3MBTL1TDP1CYP2C19
SCHEMBL10066020 0.98 ALDH1A1 (0.56) ALDH1A1MAPTL3MBTL1TDP1CYP2C19
SCHEMBL9174169 0.98 ALDH1A1 (0.56) ALDH1A1MAPTL3MBTL1TDP1CYP2C19
SCHEMBL9158964 0.98 ALDH1A1 (0.56) ALDH1A1MAPTL3MBTL1TDP1CYP2C19
SCHEMBL8766574 0.95 ALDH1A1 (0.46) ALDH1A1MAPTL3MBTL1TDP1CYP2C19
SCHEMBL20059552 0.93 ALDH1A1 (0.52) ALDH1A1MAPTL3MBTL1TDP1CYP2C19
SCHEMBL9163050 0.91 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1TDP1CYP2C19
SCHEMBL9250177 0.91 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1TDP1CYP2C19
SCHEMBL9169897 0.91 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1TDP1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109251148-A Coating molecular structure, production method and corresponding OLED device 武汉华星光电半导体显示技术有限公司 2019-01-22 CN claimed
US-11858911-B2 Squarylium compounds and infrared cut films, infrared cut filters and electronic devices including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-01-02 US disclosed
WO-2023182377-A1 HIGH-MOLECULAR-WEIGHT TRIARYLAMINE COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT 保土谷化学工業株式会社 2023-09-28 WO disclosed
EP-4219586-A1 THERMALLY-CROSSLINKABLE LOW MOLECULAR WEIGHT COMPOUND-CONTAINING COMPOSITION FOR LIGHT EMITTING DIODE Hodogaya Chemical Co., Ltd. (JP) 2023-08-02 EP disclosed
WO-2022191141-A1 HIGH MOLECULAR WEIGHT COMPOUNDS HAVING INDENO-DIBENZOHETEROLE STRUCTURE AS PARTIAL STRUCTURE, AND ORGANIC ELECTROLUMINESCENT ELEMENTS COMPRISING SAID HIGH MOLECULAR WEIGHT COMPOUNDS 保土谷化学工業株式会社 2022-09-15 WO disclosed
WO-2021070878-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT HAVING ORGANIC LAYER COMPRISING HIGH MOLECULAR WEIGHT COMPOUND 保土谷化学工業株式会社 2021-04-15 WO disclosed
CN-109251148-A Coating molecular structure, production method and corresponding OLED device 武汉华星光电半导体显示技术有限公司 2019-01-22 CN disclosed
EP-3309804-A1 PHOTOELECTRIC CONVERSION ELEMENT, DYE-SENSITIZED SOLAR CELL, METAL COMPLEX DYE, DYE SOLUTION AND OXIDE SEMICONDUCTOR ELECTRODE Fujifilm Corporation (JP) 2018-04-18 EP disclosed
US-9691983-B2 Composition containing polymer compound and light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-27 US disclosed
US-9691983-B2 Composition containing polymer compound and light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-27 US disclosed
US-7115784-B2 Copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2006-10-03 US disclosed
CN-1235232-C Semiconductor shielding layer composition UNION CARBIDE CHEM PLASTIC (US) 2006-01-04 CN disclosed
US-20050215794-A1 Copper-catalyzed formation of carbon heteroatom and carbon-carbon bonds NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-09-29 US disclosed
US-6867298-B2 Copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2005-03-15 US disclosed
US-6759554-B2 Copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2004-07-06 US disclosed
CN-1494721-A Semiconductor shielding layer composition ����̼����ѧ�����ϼ�����˾ 2004-05-05 CN disclosed
EP-1390340-A1 COPPER-CATALYZED FORMATION OF CARBON-HETEROATOM AND CARBON-CARBON BONDS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2004-02-25 EP disclosed
US-20040019216-A1 Copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-01-29 US disclosed
US-20030065187-A1 Copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-04-03 US disclosed
WO-2002085838-A1 COPPER-CATALYZED FORMATION OF CARBON-HETEROATOM AND CARBON-CARBON BONDS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2002-10-31 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 (4 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-20050215794-A1 Copper-catalyzed formation of carbon heteroatom and carbon-carbon bonds CBR3, ADH5, IDH1 ALDH1A1 30/4885MAPT 2527/4885L3MBTL1 1728/4885
US-20030065187-A1 Copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds ADH5, CBR3, ALDH3A1 ALDH1A1 26/4885MAPT 2654/4885L3MBTL1 1527/4885
US-20040019216-A1 Copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds ADH5, CBR3, ALDH3A1 ALDH1A1 26/4885MAPT 2654/4885L3MBTL1 1527/4885
US-11858911-B2 Squarylium compounds and infrared cut films, infrared cut filters and electronic devices including the same CUTA, SQLE, HMGCR ALDH1A1 1585/4885MAPT 1494/4885L3MBTL1 3737/4885

“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.