SCHEMBL547541

SCHEMBL547541

O=Cc1c(C(=O)O)cc2cc3ccccc3cc2c1C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.47
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 4/20 0.44
HPGD P15428 4/20 0.44
MAPT P10636 2/20 0.42
GFER P55789 1/20 0.42
NGLY1 Q96IV0 1/20 0.42
CYP2D6 P10635 1/20 0.42
HSD17B10 Q99714 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NR4A1 P22736 1/20 0.42
NR4A2 P43354 1/20 0.42
NR4A3 Q92570 1/20 0.42
GLA P06280 1/20 0.42
PTPN1 P18031 1/20 0.41
GAA P10253 1/20 0.41
GPR35 Q9HC97 3/20 0.41

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
SCHEMBL548199 0.98 IDO1 (0.46) IDO1ALDH1A1KDM4EHPGDMAPT
SCHEMBL547570 0.98 IDO1 (0.46) IDO1ALDH1A1KDM4EHPGDMAPT
SCHEMBL547795 0.87 WDR5 (0.47) IDO1ALDH1A1KDM4EHPGDMAPT
SCHEMBL28906694 0.86 CYP2D6 (0.51) IDO1ALDH1A1KDM4EHPGDCYP2D6
SCHEMBL547788 0.78 SOS1 (0.51) ALDH1A1KDM4EHPGDMAPTCYP2D6
SCHEMBL5149391 0.78 KDM4E (0.47) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL29221780 0.77 MEN1 (0.59) IDO1ALDH1A1KDM4EHPGDCYP2D6
SCHEMBL547982 0.76 KDM4E (0.46) IDO1ALDH1A1KDM4EHPGDMAPT
SCHEMBL28521052 0.76 SOS1 (0.50) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL547879 0.75 KDM4E (0.49) IDO1ALDH1A1KDM4EHPGDMAPT

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 10 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
CN-108008600-B Radiation-sensitive composition 三菱瓦斯化学株式会社 2021-02-09 CN disclosed
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 IDO1 4562/4885ALDH1A1 4594/4885KDM4E 165/4885
US-20100047709-A1 RADIATION-SENSITIVE COMPOSITION C1S, C9, RAD51 IDO1 3913/4885ALDH1A1 1078/4885KDM4E 234/4885

“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.