SCHEMBL2533617

SCHEMBL2533617

O=C(O)c1cc(-c2ccccc2-c2ccccc2)ccc1O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACMSD Q8TDX5 10/20 0.76
▸ MCL1 Q07820 8/20 0.76
▸ HNF4A P41235 3/20 0.76
▸ DHFR P00374 2/20 0.76
▸ KDM4E B2RXH2 1/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ USP2 O75604 1/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ CA1 P00915 1/20 0.57
▸ CA2 P00918 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ TTR P02766 1/20 0.57
▸ ALB P02768 1/20 0.57
▸ HMGB1 P09429 1/20 0.57
▸ HPGD P15428 1/20 0.57
▸ CXCL12 P48061 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ HIF1A Q16665 1/20 0.57
▸ SLC22A6 Q4U2R8 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57

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
SCHEMBL17202660 0.96 MCL1 (0.77) ACMSDMCL1HNF4ADHFRKDM4E
SCHEMBL330602 0.86 ACMSD (1.00) ACMSDMCL1HNF4ADHFRLCK
SCHEMBL23143193 0.86 ACMSD (1.00) ACMSDMCL1HNF4ADHFRLCK
SCHEMBL9273036 0.86 ACMSD (1.00) ACMSDMCL1HNF4ADHFRLCK
SCHEMBL29759663 0.86 ACMSD (1.00) ACMSDMCL1HNF4ADHFRLCK
SCHEMBL28515959 0.85 PTPN1 (0.55) ACMSDMCL1HNF4ADHFRALDH1A1
SCHEMBL9652822 0.85 ACMSD (0.96) ACMSDMCL1HNF4ADHFRLCK
SCHEMBL4260330 0.84 MCL1 (1.00) ACMSDMCL1HNF4ADHFRKDM4E
SCHEMBL412439 0.84 ACMSD (1.00) ACMSDMCL1HNF4ADHFRKDM4E
SCHEMBL2557486 0.83 MCL1 (0.69) ACMSDMCL1HNF4ADHFRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2394980-B1 AROMATIC AMINO COMPOUND MANUFACTURING METHOD HODOGAYA CHEMICAL CO LTD (JP) 2016-12-21 — — EP disclosed
US-9238624-B2 Method of producing aromatic amino compounds HODOGAYA CHEMICAL CO., LTD. (JP) 2016-01-19 — — US disclosed
US-20140163232-A1 METHOD OF PRODUCING AROMATIC AMINO COMPOUNDS HODOGAYA CHEMICAL CO., LTD. (JP) 2014-06-12 — — US disclosed
US-8735626-B2 Method of producing aromatic amino compounds HODOGAYA CHEMICAL CO., LTD. (JP) 2014-05-27 — — US disclosed
EP-2394980-A1 AROMATIC AMINO COMPOUND MANUFACTURING METHOD Hodogaya Chemical Co., Ltd. (JP) 2011-12-14 — — EP disclosed
US-20110257404-A1 METHOD OF PRODUCING AROMATIC AMINO COMPOUNDS HODOGAYA CHEMICAL CO., LTD. (JP) 2011-10-20 — — 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 (2 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-20140163232-A1 METHOD OF PRODUCING AROMATIC AMINO COMPOUNDS DDC, AOC2, AOC3 ACMSD 43/4885MCL1 3218/4885HNF4A 2672/4885
US-20110257404-A1 METHOD OF PRODUCING AROMATIC AMINO COMPOUNDS AOC2, AOC3, DDC ACMSD 63/4885MCL1 2994/4885HNF4A 3115/4885

“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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