SCHEMBL3673241

SCHEMBL3673241

O=C1C=CC(=O)C(N(CCCl)CCCl)=C1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ ERBB2 P04626 1/20 0.30

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
SCHEMBL3341534 0.79 MAPT (0.37) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL28549550 0.79 ACHE (0.40) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL28570427 0.76 ACHE (0.46) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL28562469 0.74 ACHE (0.38) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL28553031 0.73 ACHE (0.51) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL15517522 0.69 SLC29A1 (0.35) ALDH1A1MAPTRECQLERBB2
SCHEMBL5179874 0.66 ERBB2 (0.41) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL8756842 0.64 ALDH1A1 (0.35) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL27528950 0.62 ACHE (0.53) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL2027891 0.61 MAOA (0.48) MEN1ALDH1A1MAPTHPGDALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10398676-B2 Use of alpha-hydroxy carbonyl compounds as reducing agents MORVUS TECHNOLOGY LIMITED (GB) 2019-09-03 — — US disclosed
US-20180140575-A1 USE OF ALPHA-HYDROXY CARBONYL COMPOUNDS AS REDUCING AGENTS GORDIAN PHARMA LIMITED (GB) 2018-05-24 — — US disclosed
US-9907784-B2 Use of alpha-hydroxy carbonyl compounds as reducing agents MORVUS TECHNOLOGY LIMITED (GB) 2018-03-06 — — US disclosed
US-20150231113-A1 USE OF ALPHA-HYDROXY CARBONYL COMPOUNDS AS REDUCING AGENTS GORDIAN PHARMA LIMITED (GB) 2015-08-20 — — US disclosed
US-9029569-B2 Use of alpha-hydroxy carbonyl compounds as reducing agents MORVUS TECHNOLOGY LIMITED (GB) 2015-05-12 — — US disclosed
EP-1951213-B1 USE OF ALPHA-HYDROXY CARBONYL COMPOUNDS AS REDUCING AGENTS MORVUS TECHNOLOGY LTD (GB) 2012-11-14 — — EP disclosed
EP-2258430-A2 5-(Aziridin-1-yl)-4-hydroxylamino-2-nitrobenzamide and its use in medicine Morvus Technology Ltd. (GB) 2010-12-08 — — EP disclosed
US-20100104515-A1 USE OF ALPHA-HYDROXY CARBONYL COMPOUNDS AS REDUCING AGENTS GORDIAN PHARMA LIMITED (GB) 2010-04-29 — — 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-20100104515-A1 USE OF ALPHA-HYDROXY CARBONYL COMPOUNDS AS REDUCING AGENTS DERA, HOGA1, ALDOA MEN1 4352/4885ALDH1A1 78/4885MAPT 3157/4885
US-10398676-B2 Use of alpha-hydroxy carbonyl compounds as reducing agents DERA, HOGA1, ALDOA MEN1 4352/4885ALDH1A1 78/4885MAPT 3157/4885
US-20180140575-A1 USE OF ALPHA-HYDROXY CARBONYL COMPOUNDS AS REDUCING AGENTS DERA, HOGA1, ALDOA MEN1 4352/4885ALDH1A1 78/4885MAPT 3157/4885
US-20150231113-A1 USE OF ALPHA-HYDROXY CARBONYL COMPOUNDS AS REDUCING AGENTS DERA, HOGA1, ALDOA MEN1 4352/4885ALDH1A1 78/4885MAPT 3157/4885

“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.

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