SCHEMBL4459657

SCHEMBL4459657

Cn1c2c(c3ccccc3c1=O)C(=O)c1cc(OCc3ccccc3)c(OCc3ccccc3)cc1-2

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.44
SRD5A1 P18405 1/20 0.41
SRD5A2 P31213 1/20 0.41
RXRA P19793 5/20 0.41
CTSL P07711 2/20 0.40
CTSB P07858 1/20 0.40
CTSV O60911 1/20 0.40
TACR1 P25103 1/20 0.39
MAOB P27338 1/20 0.39
MAPK14 Q16539 1/20 0.39
STAT3 P40763 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL7239832 0.89 SRD5A1 (0.48) TDP1SRD5A1SRD5A2CTSLCTSB
SCHEMBL20944792 0.82 RXRA (0.48) TDP1RXRATACR1
SCHEMBL16312476 0.74 TDP1 (0.60) TDP1RXRA
SCHEMBL20944803 0.73 NTRK1 (0.52) TDP1RXRA
SCHEMBL4449715 0.72 TDP1 (0.44) TDP1RXRAHTT
SCHEMBL19450185 0.71 CTSV (0.56) SRD5A1SRD5A2CTSLCTSVSMN1; SMN2
SCHEMBL20944805 0.71 TDP1 (0.49) TDP1RXRA
SCHEMBL20944809 0.71 TDP1 (0.49) TDP1RXRA
SCHEMBL4459616 0.70 EPHX2 (0.44) TDP1RXRATACR1SMN1; SMN2
SCHEMBL20944823 0.68 ALDH1A1 (0.49) RXRAHTT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230204593-A1 MICROVESICLE HISTONE H2AX AS A BIOMARKER FOR GENOTOXIC STRESS PIOMA, INC. 2023-06-29 US disclosed
US-11513125-B2 Microvesicle histone H2AX as a biomarker for genotoxic stress PIOMA, INC. (US) 2022-11-29 US disclosed
EP-2971282-B1 MICROVESICLE HISTONE H2AX AS A BIOMARKER FOR GENOTOXIC STRESS PIOMA INC (US) 2018-09-19 EP disclosed
US-20160041175-A1 MICROVESICLE HISTONE H2AX AS A BIOMARKER FOR GENOTOXIC STRESS PIOMA, INC. 2016-02-11 US disclosed
EP-2050452-A1 indenoisoquinolines as topoisomerase inhibitors I useful as antineoplastic agents Purdue Research Foundation (US) 2009-04-22 EP disclosed
US-6509344-B1 A method for treating a patient having cancer, said method comprising the step of administering to the patient an effective amount of a compound according to claim 1, whereupon said patient is treated for cancer, and wherein the cancer is THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2003-01-21 US disclosed