SCHEMBL1663773

SCHEMBL1663773

[C]1=[C]c2cccc3cccc1c23

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.50
HSD17B10 Q99714 7/20 0.50
HPGD P15428 7/20 0.50
TSHR P16473 5/20 0.50
CYP3A4 P08684 4/20 0.50
CYP1A2 P05177 3/20 0.50
CYP1A1 P04798 2/20 0.50
CYP1B1 Q16678 2/20 0.50
MAPK1 P28482 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ATM Q13315 1/20 0.41
THRB P10828 1/20 0.39
CES2 O00748 1/20 0.38
BCHE P06276 1/20 0.38
CES1 P23141 1/20 0.38
MCL1 Q07820 1/20 0.38
KDM4E B2RXH2 4/20 0.36
GAA P10253 4/20 0.36
MAPT P10636 3/20 0.36
CASP1 P29466 2/20 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
SCHEMBL28125443 0.81 ALDH1A1 (0.50) ALDH1A1HSD17B10HPGDTSHRCYP3A4
SCHEMBL1666287 0.77 ALDH1A1 (0.35) ALDH1A1HSD17B10HPGDTSHRCYP3A4
SCHEMBL12520831 0.73 ALDH1A1 (0.36) ALDH1A1HSD17B10HPGDTSHRCYP3A4
Pyrene SCHEMBL28298301 0.72 ALDH1A1 (0.92) ALDH1A1HSD17B10HPGDTSHRCYP3A4
Pyrene SCHEMBL1332849 0.68 ALDH1A1 (1.00) ALDH1A1HSD17B10HPGDTSHRCYP3A4
Pyrene SCHEMBL29429699 0.68 ALDH1A1 (1.00) ALDH1A1HSD17B10HPGDTSHRCYP3A4
Pyrene SCHEMBL223412 0.68 ALDH1A1 (1.00) ALDH1A1HSD17B10HPGDTSHRCYP3A4
Pyrene SCHEMBL9130 0.68 ALDH1A1 (1.00) ALDH1A1HSD17B10HPGDTSHRCYP3A4
Pyrene SCHEMBL1650929 0.68 ALDH1A1 (1.00) ALDH1A1HSD17B10HPGDTSHRCYP3A4
Pyrene SCHEMBL23319293 0.65 ALDH1A1 (0.92) ALDH1A1HSD17B10HPGDTSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10038152-B2 Organic light-emitting element CANON KABUSHIKI KAISHA (JP) 2018-07-31 US claimed
US-5312707-A Compositions for images RICOH COMPANY, LTD. (JP) 1994-05-17 US claimed
CN-117209415-A Organic compound, light-emitting device, and light-receiving device 株式会社半导体能源研究所 2023-12-12 CN disclosed
US-11067909-B2 Terphenyl compound, electrophotographic photosensitive member, and method for producing terphenyl compound KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2021-07-20 US disclosed
US-20200231535-A1 TERPHENYL COMPOUND, ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, AND METHOD FOR PRODUCING TERPHENYL COMPOUND KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2020-07-23 US disclosed
US-10038152-B2 Organic light-emitting element CANON KABUSHIKI KAISHA (JP) 2018-07-31 US disclosed
US-9899613-B2 Organic light-emitting element CANON KABUSHIKI KAISHA (JP) 2018-02-20 US disclosed
EP-2939289-B1 ORGANIC LIGHT-EMITTING ELEMENT CANON KK (JP) 2017-07-26 EP disclosed
US-20160141506-A1 NAPHTHO[2,1-b]FLUORANTHENE COMPOUND, ORGANIC LIGHT-EMITTING DEVICE, DISPLAY APPARATUS, LIGHTING APPARATUS, IMAGE FORMING APPARATUS, AND EXPOSING APPARATUS CANON KABUSHIKI KAISHA (JP) 2016-05-19 US disclosed
US-9240553-B2 Indeno[1,2-b]phenanthrene compound and organic light emitting element including the same CANON KABUSHIKI KAISHA (JP) 2016-01-19 US disclosed
US-20150372244-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-12-24 US disclosed
CN-1222165-A Polyolefin microspheres MINNESOTA MINING & MFG (US) 1999-07-07 CN disclosed
CN-1222180-A Alpha-olefin adhesive compsns. MINNESOTA MINING & MFG (US) 1999-07-07 CN disclosed
EP-0906347-A1 POLYOLEFIN MICROSPHERES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-04-07 EP disclosed
EP-0904332-A1 ALPHA-OLEFIN ADHESIVE COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-03-31 EP disclosed
EP-0859799-A2 POLYMERIZABLE COMPOSITIONS COMPRISING ALPHA-OLEFIN HYDROCARBON MONOMERS AND METHODS OF USE THEREFOR MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-08-26 EP disclosed
WO-1997048739-A1 POLYOLEFIN MICROSPHERES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-12-24 WO disclosed
WO-1997048777-A1 ALPHA-OLEFIN ADHESIVE COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-12-24 WO disclosed
WO-1997017380-A2 POLYMERIZABLE COMPOSITIONS COMPRISING ALPHA-OLEFIN HYDROCARBON MONOMERS AND METHODS OF USE THEREFOR MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-05-15 WO disclosed
US-5312707-A Compositions for images RICOH COMPANY, LTD. (JP) 1994-05-17 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 (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-10038152-B2 Organic light-emitting element NFE2L2, EML4, LEF1 ALDH1A1 715/4885HSD17B10 3906/4885HPGD 3109/4885
US-11067909-B2 Terphenyl compound, electrophotographic photosensitive member, and method for producing terphenyl compound ABCB1, TERB1, PAH ALDH1A1 1436/4885HSD17B10 2637/4885HPGD 2351/4885
US-20160141506-A1 NAPHTHO[2,1-b]FLUORANTHENE COMPOUND, ORGANIC LIGHT-EMITTING DEVICE, DISPLAY APPARATUS, LIGHTING APPARATUS, IMAGE FORMING APPARATUS, AND EXPOSING APPARATUS NAP1L1, NR0B2, AFF1 ALDH1A1 479/4885HSD17B10 602/4885HPGD 2729/4885
US-20200231535-A1 TERPHENYL COMPOUND, ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, AND METHOD FOR PRODUCING TERPHENYL COMPOUND ABCB1, TERB1, PAH ALDH1A1 1436/4885HSD17B10 2637/4885HPGD 2351/4885

“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.