SCHEMBL394160

SCHEMBL394160

[c]1ccc2cc3c(ccc4ccccc43)cc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
HSD17B10 Q99714 3/20 0.59
CYP1B1 Q16678 2/20 0.59
HIF1A Q16665 1/20 0.59
CYP1A2 P05177 3/20 0.46
HPGD P15428 2/20 0.46
CYP2A6 P11509 1/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HPRT1 P00492 3/20 0.41
ERBB2 P04626 1/20 0.40
FYN P06241 1/20 0.40
MAOA P21397 1/20 0.40
ACHE P22303 1/20 0.40
AHR P35869 1/20 0.40
CYP1A1 P04798 1/20 0.36
MAPT P10636 1/20 0.36
PAX8 Q06710 1/20 0.35
TRPM4 Q8TD43 1/20 0.35
CASP3 P42574 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
SCHEMBL17103144 1.00 ALDH1A1 (0.59) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL27980290 0.94 ALDH1A1 (0.48) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL28814502 0.94 ALDH1A1 (0.48) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL398847 0.89 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL1168307 0.89 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL18221939 0.89 ALDH1A1 (0.64) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL508946 0.84 ALDH1A1 (0.37) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
Water SCHEMBL28067574 0.84 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL18529 0.84 ALDH1A1 (0.37) ALDH1A1HSD17B10HIF1ACYP1A2HPGD
SCHEMBL3775172 0.82 ALDH1A1 (0.45) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2

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
WO-2019076198-A1 COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE 北京鼎材科技有限公司 2019-04-25 WO claimed
US-8101290-B2 Organic compound having electron-transporting and/or hole-blocking performance and its use and OLEDs comprising the compound TECHNICAL INSTITUTE OF PHYSICS AND CHEMISTRY OF CHINESE ACADEMY OF SCIENCES (CN) 2012-01-24 US claimed
US-20090102356-A1 NOVEL ORGANIC COMPOUND HAVING ELECTRON-TRANSPORTING AND/OR HOLE-BLOCKING PERFORMANCE AND ITS USE AND OLEDs COMPRISING THE COMPOUND TECHNICAL INSTITUTE OF PHYSICS AND CHEMISTRY OF CHINESE ACADEMY OF SCIENCES (CN) 2009-04-23 US claimed
WO-2024114085-A1 TRIARYLAMINE ORGANIC COMPOUND AND USE THEREOF, AND ORGANIC ELECTROLUMINESCENT DEVICE 北京鼎材科技有限公司 2024-06-06 WO disclosed
US-20240026149-A1 CURING AGENT, METHOD OF PRODUCING CURING AGENT, AND CURABLE COMPOSITION DEXERIALS CORPORATION (JP) 2024-01-25 US disclosed
WO-2024012365-A1 ORGANIC COMPOUND AND USE THEREOF 清华大学 2024-01-18 WO disclosed
US-20230422617-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY APPARATUS KUNSHAN GO-VISIONOX OPTO-ELECTRONICS CO., LTD (CN) 2023-12-28 US disclosed
EP-4291000-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY APPARATUS Kunshan Go-Visionox Opto-Electronics Co., Ltd. (CN) 2023-12-13 EP disclosed
US-11795264-B2 Latent curing agent and method for manufacturing same, composition for forming coating film, and cation-curable composition DEXERIALS CORPORATION (JP) 2023-10-24 US disclosed
WO-2023095601-A1 LATENT CURING AGENT AND METHOD FOR PRODUCING SAME, AND CURABLE COMPOSITION デクセリアルズ株式会社 2023-06-01 WO disclosed
WO-2023282174-A1 CURABLE COMPOSITION, AND CURED PRODUCT デクセリアルズ株式会社 2023-01-12 WO disclosed
US-8198342-B2 Aluminum chelate latent curing agent and production method thereof SONY CHEMICAL AND INFORMATION DEVICE CORPORATION (JP) 2012-06-12 US disclosed
US-8101290-B2 Organic compound having electron-transporting and/or hole-blocking performance and its use and OLEDs comprising the compound TECHNICAL INSTITUTE OF PHYSICS AND CHEMISTRY OF CHINESE ACADEMY OF SCIENCES (CN) 2012-01-24 US disclosed
US-20110196110-A1 ALUMINUM CHELATE LATENT CURING AGENT AND PRODUCTION METHOD THEREOF SONY CHEMICAL & INFORMATION DEVICE CORPORATION (JP) 2011-08-11 US disclosed
US-20100331435-A1 ALUMINUM CHELATE LATENT CURING AGENT AND PRODUCTION METHOD THEREOF SONY CHEMICAL & INFORMATION DEVICE CORP. (JP) 2010-12-30 US disclosed
US-20090102356-A1 NOVEL ORGANIC COMPOUND HAVING ELECTRON-TRANSPORTING AND/OR HOLE-BLOCKING PERFORMANCE AND ITS USE AND OLEDs COMPRISING THE COMPOUND TECHNICAL INSTITUTE OF PHYSICS AND CHEMISTRY OF CHINESE ACADEMY OF SCIENCES (CN) 2009-04-23 US disclosed
CN-101348484-A Pyrido[3,2-h]quinazolines and/or 5,6-dihydro derivatives thereof, a method for the production thereof and doped organic semiconductor material containing these NOVALED AG (DE) 2009-01-21 CN disclosed
EP-1357936-A4 BIOCATALYTIC AND BIOMIMETIC GENERATION OF NITRIC OXIDE i IN SITU /i AT SUBSTRATE/BLOOD INTERFACES UNIV MICHIGAN (US) 2005-08-10 EP disclosed
EP-1357936-A1 BIOCATALYTIC AND BIOMIMETIC GENERATION OF NITRIC OXIDE i IN SITU /i AT SUBSTRATE/BLOOD INTERFACES THE BOARD OF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2003-11-05 EP disclosed
WO-2002056904-A1 BIOCATALYTIC AND BIOMIMETIC GENERATION OF NITRIC OXIDE IN SITU AT SUBSTRATE/BLOOD INTERFACES THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2002-07-25 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 (2 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-20090102356-A1 NOVEL ORGANIC COMPOUND HAVING ELECTRON-TRANSPORTING AND/OR HOLE-BLOCKING PERFORMANCE AND ITS USE AND OLEDs COMPRISING THE COMPOUND SLCO4C1, SLCO1B1, SLCO2B1 ALDH1A1 2684/4885HSD17B10 1708/4885CYP1B1 1445/4885
US-20230422617-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY APPARATUS OCIAD1, OCIAD2, EML4 ALDH1A1 86/4885HSD17B10 2923/4885CYP1B1 3039/4885

“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.