SCHEMBL548577

SCHEMBL548577

O=Cc1oc2c(C(=O)O)c(C=O)c(C=O)c(C=O)c2c(=O)c1-c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ LMNA P02545 3/20 0.36
▸ GAA P10253 2/20 0.36
▸ GLA P06280 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ HSP90AA1 P07900 1/20 0.35
▸ ERAP1 Q9NZ08 1/20 0.33
▸ MAPT P10636 4/20 0.32
▸ HTT P42858 3/20 0.32
▸ RAB9A P51151 3/20 0.32
▸ APAF1 O14727 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ BCL2 P10415 1/20 0.31

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
SCHEMBL547597 0.82 ABCB1 (0.40) ALDH1A1KDM4ELMNAGAAGLA
SCHEMBL547722 0.76 MEN1 (0.42) ALDH1A1KDM4ELMNATSHRHSD17B10
SCHEMBL548288 0.75 MEN1 (0.39) ALDH1A1KDM4ELMNAGAAGLA
SCHEMBL548032 0.72 FABP4 (0.41) ALDH1A1KDM4ELMNAMAPTHTT
SCHEMBL548149 0.71 MEN1 (0.42) ALDH1A1KDM4ELMNAHSD17B10KMT2A
SCHEMBL547716 0.71 FABP4 (0.41) ALDH1A1KDM4ELMNAMAPTHTT
SCHEMBL29793488 0.70 PTPN1 (0.39) ALDH1A1KDM4ELMNAKMT2AMEN1
SCHEMBL548670 0.70 PTPN1 (0.39) ALDH1A1KDM4ELMNAKMT2AMEN1
SCHEMBL547866 0.67 CA1 (0.39) ALDH1A1KDM4ELMNAGLAHSD17B10
SCHEMBL8784386 0.64 ALDH1A1 (0.43) ALDH1A1KDM4ELMNAGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2080750-B1 RADIATION-SENSITIVE COMPOSITION MITSUBISHI GAS CHEMICAL CO (JP) 2020-07-29 — — EP claimed
EP-2080750-B1 RADIATION-SENSITIVE COMPOSITION MITSUBISHI GAS CHEMICAL CO (JP) 2020-07-29 — — EP disclosed
US-9897913-B2 Radiation-sensitive composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2018-02-20 — — US disclosed
US-20150030980-A1 RADIATION-SENSITIVE COMPOSITION MITSUBISHI GAS CHEMICAL CO (JP) 2015-01-29 — — US disclosed
US-8846292-B2 Radiation-sensitive composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2014-09-30 — — US disclosed
US-20120171379-A1 RADIATION-SENSITIVE COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-07-05 — — US disclosed
US-8110334-B2 Radiation-sensitive composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-02-07 — — US disclosed
US-20100047709-A1 RADIATION-SENSITIVE COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-02-25 — — US disclosed
EP-2080750-A1 RADIATION-SENSITIVE COMPOSITION Mitsubishi Gas Chemical Company, Inc. (JP) 2009-07-22 — — EP 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-20120171379-A1 RADIATION-SENSITIVE COMPOSITION PARG, RAD51, SRMS ALDH1A1 4594/4885KDM4E 165/4885LMNA 469/4885
US-20100047709-A1 RADIATION-SENSITIVE COMPOSITION C1S, C9, RAD51 ALDH1A1 1078/4885KDM4E 234/4885LMNA 286/4885

“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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