SCHEMBL8845451

SCHEMBL8845451

O=C(O)CC=C1c2ccc(O)cc2Oc2cc(O)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.41
▸ TYR P14679 4/20 0.41
▸ MAOA P21397 4/20 0.41
▸ MEN1 O00255 7/20 0.40
▸ KMT2A Q03164 7/20 0.40
▸ POLB P06746 2/20 0.40
▸ USP2 O75604 2/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ HSP90AB1 P08238 1/20 0.40
▸ BRCA1 P38398 1/20 0.40
▸ YWHAG P61981 1/20 0.40
▸ KEAP1 Q14145 1/20 0.40
▸ NFE2L2 Q16236 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ RECQL P46063 2/20 0.38
▸ CISD1 Q9NZ45 2/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38

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
SCHEMBL13542765 0.86 TYR (0.40) MAOBTYRMAOAMEN1KMT2A
SCHEMBL12693590 0.75 MAOA (0.37) MAOBTYRMAOAMEN1KMT2A
SCHEMBL8845603 0.69 TYR (0.39) TYR
SCHEMBL8845448 0.68 MEN1 (0.43) MAOBTYRMAOAMEN1KMT2A
SCHEMBL23460330 0.65 MAOA (0.43) MAOBTYRMAOAMEN1KMT2A
SCHEMBL29919352 0.65 MAOA (0.43) MAOBTYRMAOAMEN1KMT2A
SCHEMBL8845526 0.65 HMGB1 (0.31) —
SCHEMBL22046626 0.65 MAOB (0.48) MAOBTYRMAOAMEN1KMT2A
Isoaurostatin SCHEMBL15426107 0.65 MAOA (0.63) MAOBTYRMAOAMEN1KMT2A
Isoaurostatin SCHEMBL29551912 0.65 MAOA (0.63) MAOBTYRMAOAMEN1KMT2A

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5625081-A XANTHENE DYE DERIVATIVES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1997-04-29 — — US disclosed
US-5608063-A Method, system and reagents for DNA sequencing E. I. DU PONT DE NEMOURS AND COMPANY (US) 1997-03-04 — — US disclosed
US-5558991-A DNA sequencing method using acyclonucleoside triphosphates E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-09-24 — — US disclosed
EP-0309969-B1 Method of gene mapping DU PONT (US) 1995-07-19 — — EP disclosed
EP-0252683-B1 Process and reagents for DNA sequence analysis DU PONT (US) 1995-01-18 — — EP disclosed
EP-0251786-B1 Alkynylamino-nucleotides DU PONT (US) 1994-11-30 — — EP disclosed
US-5332666-A Reporter-labeled chain terminator reacted with DNA nucleotides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-07-26 — — US disclosed
US-5306618-A Using xanthene dye reporter labeled DNA fragments E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-04-26 — — US disclosed
US-5242796-A Fluorescent xanthene dye E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-09-07 — — US disclosed
US-5151507-A Alkynylamino-nucleotides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-09-29 — — US disclosed
US-5102785-A Cleaving to produce DNA fragment which are then end labeled with reporter, again cleaved to produce short fragment, separatiion; analysis E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-07 — — US disclosed
US-5047519-A Alkynylamino-nucleotides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-09-10 — — US disclosed
EP-0309969-A2 Method of gene mapping E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-04-05 — — EP disclosed
EP-0252683-A2 Process and reagents for DNA sequence analysis E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-01-13 — — EP disclosed
EP-0251786-A2 Alkynylamino-nucleotides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-01-07 — — EP disclosed
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