SCHEMBL548758

SCHEMBL548758

O=Cc1c(C(=O)O)ccc(-c2ccccc2)c1C=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.50
HNF4A P41235 3/20 0.46
FOLH1 Q04609 1/20 0.44
PTPN1 P18031 4/20 0.43
FABP3 P05413 1/20 0.42
FABP4 P15090 1/20 0.42
FABP5 Q01469 1/20 0.42
ACMSD Q8TDX5 2/20 0.42
PTPN6 P29350 2/20 0.41
ALDH1A1 P00352 2/20 0.41
ALOX15 P16050 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41
PTPN2 P17706 1/20 0.40
BCAT2 O15382 1/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CASP1 P29466 1/20 0.39

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
SCHEMBL5268526 0.85 HNF4A (0.59) ERN1HNF4AFOLH1PTPN1FABP3
SCHEMBL28338084 0.84 MEN1 (0.46) ALDH1A1LMNACASP1HSD17B10
SCHEMBL548518 0.84 PTPN1 (0.46) ERN1HNF4AFOLH1PTPN1FABP3
SCHEMBL29760459 0.79 HNF4A (0.52) ERN1HNF4AFOLH1FABP3FABP4
SCHEMBL548160 0.78 HNF4A (0.47) ERN1HNF4APTPN1FABP3FABP4
SCHEMBL548159 0.77 HNF4A (0.46) HNF4AFOLH1PTPN1FABP3FABP4
SCHEMBL31493165 0.75 KMT2A (0.42) ALDH1A1LMNACASP1
SCHEMBL547760 0.75 KMT2A (0.42) ALDH1A1LMNACASP1
SCHEMBL3970046 0.75 HDAC4 (0.50) ERN1HNF4APTPN1PTPN6ALDH1A1
SCHEMBL4371530 0.74 SLC22A6 (0.43) HNF4AFOLH1PTPN1FABP3FABP4

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 ERN1 2991/4885HNF4A 2396/4885FOLH1 2545/4885
US-20100047709-A1 RADIATION-SENSITIVE COMPOSITION C1S, C9, RAD51 ERN1 3467/4885HNF4A 2456/4885FOLH1 1898/4885

“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.