Sugi Predict

Sugi Predict / Compounds / SCHEMBL110446

SCHEMBL110446

SCHEMBL110446

O=[N+]([O-])c1ccccc1NCCO

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 2/20 0.66
▸ MAPT P10636 6/20 0.60
▸ RAB9A P51151 4/20 0.60
▸ NPC1 O15118 3/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ KMT2A Q03164 2/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ ALDH1A1 P00352 4/20 0.56
▸ TSHR P16473 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ LMNA P02545 2/20 0.54
▸ HTT P42858 1/20 0.54
▸ PKM P14618 1/20 0.53
▸ GAA P10253 1/20 0.52

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
SCHEMBL29390623 1.00 KAT2B (0.66) KAT2BMAPTRAB9ANPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL27635117 0.98 KAT2B (0.67) KAT2BMAPTRAB9ANPC1SMN1; SMN2
Diethanolamine SCHEMBL198856 0.95 KAT2B (0.60) KAT2BMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL27708810 0.94 KAT2B (0.59) KAT2BMAPTRAB9ANPC1SMN1; SMN2
Phenol SCHEMBL28187129 0.92 KAT2B (0.57) KAT2BMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL8647822 0.91 KAT2B (0.60) KAT2BMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL5922386 0.90 KAT2B (0.71) KAT2BMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL6198859 0.89 KAT2B (0.80) KAT2BMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL7745271 0.88 KAT2B (0.69) KAT2BMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL6001854 0.88 TDP1 (0.56) KAT2BMAPTRAB9ANPC1SMN1; SMN2

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 1607 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107880988-B Environment-friendly forming oil for stainless steel and preparation method thereof 广州市联诺化工科技有限公司 2021-02-09 — — CN claimed
CN-107815344-B Environment-friendly semisynthetic cutting fluid and preparation method thereof 广州市联诺化工科技有限公司 2020-08-25 — — CN claimed
EP-1437123-B2 COMPOSITION FOR DYEING KERATIN FIBRES AND DYEING METHOD USING SAME L'ORÉAL (FR) 2017-11-08 — — EP claimed
US-20170273881-A1 COSMETIC COMPOSITION FOR KERATIN FIBRES ALFA PARF GROUP S.P.A. (IT) 2017-09-28 — — US claimed
WO-2016026710-A1 COSMETIC COMPOSITION FOR KERATIN FIBRES ALFA PARF GROUP S.P.A. (IT) 2016-02-25 — — WO claimed
US-8052762-B1 Compositions for dyeing keratin-containing fibers Kelly Van Gogh, LLC (US) 2011-11-08 — — US claimed
EP-0999823-B2 COMPOSITION FOR DYEING KERATIN FIBRES AND DYEING METHOD USING SAME OREAL (FR) 2011-10-05 — — EP claimed
US-7799092-B2 Composition for simultaneously bleaching and dyeing keratin fibers, comprising at least one anionic or nonionic direct dye and at least one associative polymer L'OREAL S.A. (FR) 2010-09-21 — — US claimed
US-7736395-B2 direct dyes L'OREAL S.A. (FR) 2010-06-15 — — US claimed
EP-1738801-B1 Agent for simultaneously bleaching and coloring of keratin fibres comprising an anionic or non-ionic dye and an inert organic liquid OREAL (FR) 2010-06-09 — — EP claimed
US-5516942-A DIRECT DYES FOR HAIR FOR YELLOW OR PURPLE L'OREAL (FR) 1996-05-14 — — US claimed
EP-0673926-A1 2-Nitro-p-phenylenediamines having a sulfur atom in position 5, process for their preparation, dye compositions containing them and their use for dyeing keratinic fibres L'OREAL (FR) 1995-09-27 — — EP claimed
EP-0646108-A1 HYDROXYPROPYLATED 2-NITRO-P-PHENYLENEDIAMINES, PREPARATION METHOD THEREFOR AND USE THEREOF FOR DYEING KERATIN FIBRES L'OREAL (FR) 1995-04-05 — — EP claimed
EP-0480829-B1 Hair dyeing composition containing anthraquinones OREAL (FR) 1994-04-06 — — EP claimed
WO-1994000414-A1 HYDROXYPROPYLATED 2-NITRO-P-PHENYLENEDIAMINES, PREPARATION METHOD THEREFOR AND USE THEREOF FOR DYEING KERATIN FIBRES L'OREAL (FR) 1994-01-06 — — WO claimed
US-5226924-A 1,4-DI(MONO- OR POLY) HYDROXYALKYLAMINO-9,10-ANTHRAQUINONES FOR DYEING HUMAN KERATINOUS FIBRES, COSMETIC COMPOSITION CONTAINING THEM IN COMBINATION WITH AZO AND NITROBENZENE DYES, AND HAIR-DYEING PROCESS USING THEM L'OREAL (FR) 1993-07-13 — — US claimed
EP-0303826-B1 SUBSTITUTED 2-NITRO METAPHENYLENE DIAMINES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN DYEING KERATINOUS FIBRES AND ESPECIALLY HUMAN HAIR L'OREAL (FR) 1991-02-27 — — EP claimed
US-4981486-A Washfast, lightfast; for bleached or permed hair L'OREAL (FR) 1991-01-01 — — US claimed
EP-0303878-A2 2,5-diamino-nitro-6-pyridine derivatives containing hair dyeing agents Wella Aktiengesellschaft (DE) 1989-02-22 — — EP claimed
US-3930792-A NITROAMINOBENZENE, QUATERNARY AMINE, N-OXYALKYLATED FATTY ACID AMIDES CLAIROL INCORPORATED (US) 1976-01-06 — — 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 (1 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-20170273881-A1 COSMETIC COMPOSITION FOR KERATIN FIBRES KRT18, GRHPR, CUTA KAT2B 58/4885MAPT 565/4885RAB9A 3054/4885

“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.