SCHEMBL548665

SCHEMBL548665

O=Cc1c(C=O)c(C=O)c2c(ccc3cccc(C(=O)O)c32)c1C=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.50
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43
NR4A3 Q92570 1/20 0.43
PTPN1 P18031 1/20 0.41
ALDH1A1 P00352 4/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 2/20 0.40
TSHR P16473 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CDC25B P30305 1/20 0.39
ERN1 O75460 3/20 0.38
CYP1A2 P05177 1/20 0.38
GLA P06280 1/20 0.38
POLB P06746 1/20 0.38
CYP2D6 P10635 1/20 0.38
HPGD P15428 1/20 0.38
PARP1 P09874 1/20 0.38
WDR5 P61964 1/20 0.38

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
SCHEMBL548659 0.84 KMT2A (0.46) HSD17B10NR4A1NR4A2NR4A3PTPN1
SCHEMBL2834703 0.79 HSD17B10 (0.75) HSD17B10NR4A1NR4A2NR4A3PTPN1
SCHEMBL547833 0.78 ERN1 (0.37) HSD17B10NR4A1NR4A2NR4A3ALDH1A1
SCHEMBL548054 0.77 ALDH1A1 (0.48) HSD17B10ALDH1A1KMT2AMEN1KDM4E
Ammonia Solution, Strong SCHEMBL31590375 0.77 HSD17B10 (0.72) HSD17B10NR4A1NR4A2NR4A3PTPN1
Hydrochloric Acid SCHEMBL4607898 0.77 HSD17B10 (0.72) HSD17B10NR4A1NR4A2NR4A3PTPN1
Ammonia Solution, Strong SCHEMBL31590816 0.77 HSD17B10 (0.72) HSD17B10NR4A1NR4A2NR4A3PTPN1
SCHEMBL29953603 0.77 HSD17B10 (0.56) HSD17B10NR4A1NR4A2NR4A3PTPN1
SCHEMBL547987 0.76 KMT2A (0.43) HSD17B10NR4A1NR4A2NR4A3ALDH1A1
SCHEMBL547832 0.76 ERN1 (0.38) HSD17B10NR4A1NR4A2NR4A3ALDH1A1

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 HSD17B10 4211/4885NR4A1 419/4885NR4A2 1485/4885
US-20100047709-A1 RADIATION-SENSITIVE COMPOSITION C1S, C9, RAD51 HSD17B10 3495/4885NR4A1 421/4885NR4A2 1307/4885

“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.