SCHEMBL547879

SCHEMBL547879

O=Cc1c(C=O)c(C(=O)O)c2cc3cc4ccccc4cc3cc2c1C=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C19 P33261 2/20 0.49
HSD17B10 Q99714 2/20 0.49
MEN1 O00255 1/20 0.49
GLA P06280 1/20 0.49
HPGD P15428 1/20 0.49
KMT2A Q03164 1/20 0.49
ERN1 O75460 4/20 0.38
GAA P10253 1/20 0.37
IDO1 P14902 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
CDC25B P30305 2/20 0.33
NR4A1 P22736 1/20 0.33
NR4A2 P43354 1/20 0.33
NR4A3 Q92570 1/20 0.33
METAP2 P50579 1/20 0.33
METAP1 P53582 1/20 0.33

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
SCHEMBL548551 1.00 KDM4E (0.49) KDM4EALDH1A1CYP1A2CYP2C19HSD17B10
SCHEMBL548272 0.97 KDM4E (0.47) KDM4EALDH1A1CYP1A2CYP2C19HSD17B10
SCHEMBL547550 0.85 ALDH1A1 (0.44) KDM4EALDH1A1CYP1A2CYP2C19HSD17B10
SCHEMBL547859 0.84 ERN1 (0.44) KDM4EALDH1A1CYP1A2CYP2C19HSD17B10
SCHEMBL548819 0.84 ERN1 (0.44) KDM4EALDH1A1CYP1A2CYP2C19HSD17B10
SCHEMBL547551 0.83 KDM4E (0.45) KDM4EALDH1A1CYP1A2CYP2C19HSD17B10
SCHEMBL547981 0.83 ALDH1A1 (0.45) KDM4EALDH1A1CYP1A2CYP2C19HSD17B10
SCHEMBL547528 0.82 KDM4E (0.40) KDM4EALDH1A1CYP1A2CYP2C19HSD17B10
SCHEMBL548198 0.81 KDM4E (0.46) KDM4EALDH1A1CYP1A2CYP2C19HSD17B10
SCHEMBL547982 0.81 KDM4E (0.46) KDM4EALDH1A1CYP1A2CYP2C19HSD17B10

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 KDM4E 165/4885ALDH1A1 4594/4885CYP1A2 2962/4885
US-20100047709-A1 RADIATION-SENSITIVE COMPOSITION C1S, C9, RAD51 KDM4E 234/4885ALDH1A1 1078/4885CYP1A2 2215/4885

“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.