SCHEMBL55779

SCHEMBL55779

[c]1c2ccccc2c2ccc3cccc4ccc1c2c43

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 8/20 0.50
ALDH1A1 P00352 8/20 0.50
HPGD P15428 6/20 0.50
CYP1A2 P05177 4/20 0.50
ERBB2 P04626 1/20 0.50
FYN P06241 1/20 0.50
MAOA P21397 1/20 0.50
ACHE P22303 1/20 0.50
AHR P35869 1/20 0.50
THRB P10828 1/20 0.50
TSHR P16473 6/20 0.42
CYP3A4 P08684 3/20 0.42
CYP1B1 Q16678 3/20 0.42
CYP1A1 P04798 2/20 0.42
L3MBTL1 Q9Y468 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
HPRT1 P00492 1/20 0.38
CYP2A6 P11509 1/20 0.36
MAPK1 P28482 3/20 0.33
HIF1A Q16665 3/20 0.33

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
SCHEMBL18546816 0.84 CYP1A2 (0.59) HSD17B10ALDH1A1HPGDCYP1A2ERBB2
SCHEMBL3017005 0.82 ALDH1A1 (0.46) HSD17B10ALDH1A1HPGDCYP1A2ERBB2
SCHEMBL18546808 0.81 CYP1A2 (0.47) HSD17B10ALDH1A1HPGDCYP1A2ERBB2
SCHEMBL18546810 0.78 HSD17B10 (0.57) HSD17B10ALDH1A1HPGDCYP1A2ERBB2
SCHEMBL7774162 0.75 CYP1A2 (0.49) HSD17B10ALDH1A1HPGDCYP1A2ERBB2
SCHEMBL27923136 0.74 CYP1A2 (0.47) HSD17B10ALDH1A1HPGDCYP1A2ERBB2
SCHEMBL22159963 0.73 ALDH1A1 (0.42) HSD17B10ALDH1A1HPGDCYP1A2ERBB2
SCHEMBL18317447 0.72 ALDH1A1 (0.41) HSD17B10ALDH1A1HPGDCYP1A2ERBB2
SCHEMBL28353248 0.72 ALDH1A1 (0.41) HSD17B10ALDH1A1HPGDCYP1A2ERBB2
SCHEMBL18317668 0.72 HPGD (0.47) HSD17B10ALDH1A1HPGDCYP1A2ERBB2

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 1722 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324788-A Organic electroluminescent compound and application thereof 宁波卢米蓝新材料有限公司 2024-07-12 CN claimed
CN-118239966-A Organic electroluminescent compound and application thereof 宁波卢米蓝新材料有限公司 2024-06-25 CN claimed
WO-2024099269-A1 ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, USE THEREOF 华东师范大学 2024-05-16 WO claimed
CN-118027085-A Organic electroluminescent compound and application thereof 宁波卢米蓝新材料有限公司 2024-05-14 CN claimed
US-20240155939-A1 HETEROCYCLIC AROMATIC AMINE COMPOUND AND ELECTROLUMINESCENCE USING THE SAME WUHAN TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2024-05-09 US claimed
WO-2024088237-A1 LUMINESCENT MATERIAL, USE THEREOF, AND ORGANIC ELECTROLUMINESCENT DEVICE CONTAINING SAME 清华大学 2024-05-02 WO claimed
CN-112992967-B Photoelectric conversion element, image pickup element, stacked image pickup element, and solid-state image pickup device 索尼公司 2024-03-22 CN claimed
CN-117700432-A Organic compound and organic electroluminescent device containing same 清华大学 2024-03-15 CN claimed
WO-2024012365-A1 ORGANIC COMPOUND AND USE THEREOF 清华大学 2024-01-18 WO claimed
CN-116376481-B Negative electrode binder, negative electrode plate, battery cell, battery and electricity utilization device 宁德时代新能源科技股份有限公司 2023-10-27 CN claimed
EP-2718395-A1 NOVEL COLOR CONVERTER BASF SE (DE) 2014-04-16 EP claimed
US-8624231-B2 Benzopyrene compound and organic light-emitting element containing the same CANON KABUSHIKI KAISHA (JP) 2014-01-07 US claimed
US-8557953-B2 Polymers comprising substituted anthracenyl units, blends comprising these polymers, and devices comprising these polymers or blends MERCK PATENT GMBH (DE) 2013-10-15 US claimed
US-20130126855-A1 POLYMERS CONTAINING SUBSTITUTED BENZODITHIOPHENE UNITS, BLENDS COMPRISING THESE POLYMERS, AND DEVICES COMPRISING THESE POLYMERS OR BLENDS MERCK PATENT GMBH (DE) 2013-05-23 US claimed
WO-2012168395-A1 NOVEL COLOR CONVERTER BASF SE (DE) 2012-12-13 WO claimed
US-8313671-B2 Heterocyclic compound and use thereof HIROSHIMA UNIVERSITY (JP) 2012-11-20 US claimed
US-20120108731-A1 POLYMERS COMPRISING SUBSTITUTED ANTHRACENYL UNITS, BLENDS COMPRISING THESE POLYMERS, AND DEVICES COMPRISING THESE POLYMERS OR BLENDS MERCK PATENT GMBH (DE) 2012-05-03 US claimed
US-20110240976-A1 NOVEL BENZOPYRENE COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CONTAINING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-10-06 US claimed
US-6103883-A Glycolipid mimics and methods of use thereof HSC RESEARCH AND DEVELOPMENT LIMITED PARTNERSHIP (CA) 2000-08-15 US claimed
US-5403936-A Irradiating organic optical material comprising oxazoline derivative with light KABUSHIKI KAISHA TOSHIBA (JP) 1995-04-04 US claimed

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-20110240976-A1 NOVEL BENZOPYRENE COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CONTAINING THE SAME XDH, CRY1, YBX1 HSD17B10 1719/4885ALDH1A1 322/4885HPGD 1513/4885
US-20240155939-A1 HETEROCYCLIC AROMATIC AMINE COMPOUND AND ELECTROLUMINESCENCE USING THE SAME CCNL2, CHRM1, AHR HSD17B10 3182/4885ALDH1A1 1270/4885HPGD 3072/4885

“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.