SCHEMBL547788

SCHEMBL547788

O=Cc1c(C(=O)O)cc2c(ccc3ccccc32)c1C=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 2/20 0.51
ALDH1A1 P00352 4/20 0.49
HPGD P15428 4/20 0.49
KDM4E B2RXH2 3/20 0.49
GLA P06280 2/20 0.49
GAA P10253 1/20 0.49
WDR5 P61964 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
LDHA P00338 1/20 0.47
ERN1 O75460 1/20 0.47
NR4A1 P22736 1/20 0.47
NR4A2 P43354 1/20 0.47
NR4A3 Q92570 1/20 0.47
LMNA P02545 2/20 0.43
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
CSNK2A1 P68400 1/20 0.43
CDC25B P30305 1/20 0.42

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
SCHEMBL28521052 0.98 SOS1 (0.50) SOS1ALDH1A1HPGDKDM4EGLA
SCHEMBL28906694 0.83 CYP2D6 (0.51) ALDH1A1HPGDKDM4EGLAWDR5
SCHEMBL10946505 0.80 MEN1 (0.65) SOS1ALDH1A1HPGDKDM4EGLA
SCHEMBL547877 0.78 WDR5 (0.61) ALDH1A1HPGDKDM4EGLAGAA
SCHEMBL547541 0.78 IDO1 (0.47) ALDH1A1HPGDKDM4EGLAGAA
SCHEMBL547664 0.77 ERN1 (0.49) ALDH1A1HPGDGAAMEN1KMT2A
SCHEMBL10348819 0.76 ERN1 (0.56) SOS1ALDH1A1HPGDGAAERN1
SCHEMBL25256056 0.76 HSD17B10 (0.52) ALDH1A1HPGDKDM4EWDR5MEN1
SCHEMBL547570 0.76 IDO1 (0.46) ALDH1A1HPGDKDM4EGLAGAA
SCHEMBL548199 0.76 IDO1 (0.46) ALDH1A1HPGDKDM4EGLAGAA

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 SOS1 278/4885ALDH1A1 4594/4885HPGD 2450/4885
US-20100047709-A1 RADIATION-SENSITIVE COMPOSITION C1S, C9, RAD51 SOS1 743/4885ALDH1A1 1078/4885HPGD 3354/4885

“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.