SCHEMBL4396512

SCHEMBL4396512

CNC(=O)c1c(Br)c(OCOC)cc(OCOC)c1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 2/20 0.35
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CYP2C19 P33261 1/20 0.35
CLCN2 P51788 1/20 0.34
SMPD1 P17405 1/20 0.34
XDH P47989 1/20 0.34
CAPN1 P07384 1/20 0.34
EDNRA P25101 1/20 0.34
GSK3B P49841 2/20 0.34
BAZ2B Q9UIF8 1/20 0.34
CHEK1 O14757 1/20 0.34
RET P07949 1/20 0.34
PDGFRB P09619 1/20 0.34
PIM1 P11309 1/20 0.34
PDGFRA P16234 1/20 0.34
RPS6KA3 P51812 1/20 0.34

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
SCHEMBL4381967 0.88 LMNA (0.44) EGFRSMN1; SMN2KDM4ELMNAGSK3B
SCHEMBL4385854 0.87 EGFR (0.48) EGFRKDM4ELMNACYP2C19CLCN2
SCHEMBL4392011 0.86 EGFR (0.55) EGFRSMN1; SMN2LMNACAPN1L3MBTL1
SCHEMBL4380006 0.85 EGFR (0.46) EGFRKDM4ELMNAPOLBNPSR1
SCHEMBL4383916 0.85 EGFR (0.43) EGFRSMN1; SMN2KDM4ELMNAPOLB
SCHEMBL4388687 0.84 EGFR (0.43) EGFRSMN1; SMN2KDM4ELMNAPOLB
SCHEMBL4380965 0.83 EGFR (0.42) EGFRSMN1; SMN2KDM4ELMNACLCN2
SCHEMBL4379975 0.82 EGFR (0.41) EGFRSMN1; SMN2CYP2C19CLCN2CAPN1
SCHEMBL4386648 0.79 EGFR (0.45) EGFRSMN1; SMN2KDM4EPOLBCYP2C19
SCHEMBL4389125 0.78 EGFR (0.42) EGFRSMN1; SMN2KDM4ECYP2C19CLCN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 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 (1 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-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P EGFR 624/4885SMN1; SMN2 4471/4885KDM4E 3223/4885

“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.