SCHEMBL496556

SCHEMBL496556

[CH2]C=C(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.46
ALDH1A1 P00352 3/20 0.44
CYP19A1 P11511 2/20 0.44
CYP11B2 P19099 2/20 0.44
CYP2C19 P33261 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MCOLN3 Q8TDD5 1/20 0.44
TDP1 Q9NUW8 3/20 0.43
CES2 O00748 2/20 0.43
CES1 P23141 2/20 0.43
TSHR P16473 2/20 0.43
DAO P14920 1/20 0.43
NAPRT Q6XQN6 1/20 0.43
MAPK1 P28482 1/20 0.42
ESR1 P03372 1/20 0.41
F2 P00734 1/20 0.39
F10 P00742 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
SCHEMBL3850015 0.85 CES2 (0.56) ALDH1A1NPSR1TDP1CES2CES1
SCHEMBL3850013 0.85 CES2 (0.56) ALDH1A1NPSR1TDP1CES2CES1
SCHEMBL27773576 0.80 LOXL2 (0.50) CYP2C19CYP1A2CYP2C9CES2CES1
SCHEMBL27794822 0.80 KMT2A (0.66) ALDH1A1L3MBTL1NPSR1TDP1TSHR
SCHEMBL3875780 0.79 NFE2L2 (0.48) AKT1ALDH1A1CYP2C19L3MBTL1TDP1
SCHEMBL88322 0.78 ALDH1A1 (0.46) AKT1ALDH1A1CYP19A1CYP11B2CYP2C19
SCHEMBL3844702 0.77 KMT2A (0.38) ALDH1A1CYP2C19L3MBTL1CYP1A2CYP2C9
SCHEMBL1173621 0.77 AKT1 (0.42) AKT1ALDH1A1CYP2C19L3MBTL1TDP1
SCHEMBL1415032 0.75 ALDH1A1 (0.44) AKT1ALDH1A1CYP19A1CYP11B2CYP2C19
SCHEMBL496557 0.75 ALDH1A1 (0.44) AKT1ALDH1A1CYP19A1CYP11B2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9660195-B2 Anthracene derivative having a phenanthryl group IDEMITSU KOSAN CO., LTD. (JP) 2017-05-23 US claimed
US-8822041-B2 Anthracene derivatives, luminescent materials and organic electroluminescent devices IDEMITSU KOSAN CO., LTD. (JP) 2014-09-02 US claimed
US-20140103319-A1 ANTHRACENE DERIVATIVES, LUMINESCENT MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICES IDEMITSU KOSAN CO., LTD. (JP) 2014-04-17 US claimed
US-5580881-A ANTICHOLESTEROL AND ANTILIPEMIC AGENTS; ATHEROSCLEROSIS; FUNGICIDES; 2,3-EPOXYSQUALENE CYCLASE INHIBITORS FOURNIER INDUSTRIE ET SANTE (FR) 1996-12-03 US claimed
US-4672068-A Antihypertensive 1,4-dihydropyridines having a conjugated ester FUJIREBIO KABUSHIKI KAISHA (JP) 1987-06-09 US claimed
EP-0055562-B1 CEPHALOSPORIN DERIVATIVES ICI PHARMA (FR) 1986-02-12 EP claimed
EP-0055099-B1 PENICILLIN DERIVATIVES ICI PHARMA (FR) 1984-10-24 EP claimed
EP-0075434-A2 Cephalosporins, their preparation and their pharmaceutical compositions ICI PHARMA (FR) 1983-03-30 EP claimed
EP-0072608-A2 Process for the preparation of cephalosporin derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-02-23 EP claimed
EP-0071370-A2 Cephalosporin derivatives, process for their preparation and pharmaceutical compositions containing them ICI PHARMA (FR) 1983-02-09 EP claimed
EP-0055562-A2 Cephalosporin derivatives ICI PHARMA (FR) 1982-07-07 EP claimed
EP-0055099-A1 Penicillin derivatives ICI PHARMA (FR) 1982-06-30 EP claimed
CN-118344405-A Organic electroluminescent material and device thereof 北京夏禾科技有限公司 2024-07-16 CN disclosed
CN-118344382-A Quinoid poly condensed ring compound and electroluminescent device containing same 华南理工大学 2024-07-16 CN disclosed
CN-118344350-A Organic electroluminescent material and device thereof 北京夏禾科技有限公司 2024-07-16 CN disclosed
WO-2024140294-A1 ORGANIC COMPOUND AND APPLICATION THEREOF IN OLED DEVICE 北京云基科技股份有限公司 2024-07-04 WO disclosed
EP-0072608-A2 Process for the preparation of cephalosporin derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-02-23 EP disclosed
EP-0071370-A2 Cephalosporin derivatives, process for their preparation and pharmaceutical compositions containing them ICI PHARMA (FR) 1983-02-09 EP disclosed
EP-0055562-A2 Cephalosporin derivatives ICI PHARMA (FR) 1982-07-07 EP disclosed
EP-0055099-A1 Penicillin derivatives ICI PHARMA (FR) 1982-06-30 EP disclosed