SCHEMBL548664

SCHEMBL548664

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.36
KMT2A Q03164 6/20 0.36
MEN1 O00255 5/20 0.36
HSD17B10 Q99714 4/20 0.33
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 3/20 0.33
CYP1A2 P05177 2/20 0.33
GLA P06280 2/20 0.33
CYP2C19 P33261 1/20 0.33
POLB P06746 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
CYP2A6 P11509 1/20 0.31
METAP2 P50579 1/20 0.31
METAP1 P53582 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL548658 0.83 KMT2A (0.44) ERN1KMT2AMEN1HSD17B10KDM4E
SCHEMBL547987 0.82 KMT2A (0.43) ERN1KMT2AMEN1HSD17B10KDM4E
SCHEMBL547832 0.81 ERN1 (0.38) ERN1KMT2AMEN1HSD17B10KDM4E
SCHEMBL547733 0.81 ERN1 (0.47) ERN1KMT2AMEN1HSD17B10KDM4E
SCHEMBL547833 0.80 ERN1 (0.37) ERN1KMT2AMEN1HSD17B10KDM4E
SCHEMBL548665 0.75 HSD17B10 (0.50) ERN1KMT2AMEN1HSD17B10KDM4E
SCHEMBL22020163 0.75 KMT2A (0.50) ERN1KMT2AMEN1HSD17B10KDM4E
SCHEMBL547528 0.74 KDM4E (0.40) ERN1KMT2AMEN1HSD17B10KDM4E
SCHEMBL3299164 0.74 KMT2A (0.45) ERN1KMT2AMEN1HSD17B10KDM4E
SCHEMBL4944634 0.74 THRB (0.52) ERN1KMT2AMEN1HSD17B10ALDH1A1

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 ERN1 2991/4885KMT2A 1479/4885MEN1 1441/4885
US-20100047709-A1 RADIATION-SENSITIVE COMPOSITION C1S, C9, RAD51 ERN1 3467/4885KMT2A 645/4885MEN1 1910/4885

“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.