SCHEMBL17830795

SCHEMBL17830795

C=c1s/c(=C2\C(=O)N(CC(=O)OCc3ccccc3)c3ccc(Cl)cc32)c(=O)n1CCC(=O)NCC(=O)OCC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CCKBR P32239 2/20 0.35
PTPN1 P18031 1/20 0.34
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL17830794 0.88 CCKBR (0.38) ALDH1A1KDM4EHPGDCCKBRMAPT
SCHEMBL17830797 0.84 ALDH1A1 (0.37) ALDH1A1KDM4E
SCHEMBL17830799 0.84 ALDH1A1 (0.35) ALDH1A1KDM4EHPGDCCKBRTSHR
SCHEMBL17830801 0.83 HSP90AA1 (0.37) ALDH1A1MEN1KMT2ACCKBRMAPT
SCHEMBL17830708 0.82 CACNA1B (0.47) MEN1KMT2AUSP2POLB
SCHEMBL17830798 0.81 MEN1 (0.37) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL17830802 0.81 MDM2 (0.34) ALDH1A1KDM4ECCKBRTSHR
SCHEMBL17830803 0.79 PTPN7 (0.35) ALDH1A1KDM4EPOLB
SCHEMBL17830796 0.79 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AMAPTTSHR
SCHEMBL17830793 0.79 PARK7 (0.37) ALDH1A1MEN1KMT2AHPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160166549-A1 BCL6 INHIBITORS AS ANTICANCER AGENTS CORNELL UNIVERSITY 2016-06-16 US 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-20160166549-A1 BCL6 INHIBITORS AS ANTICANCER AGENTS BCL6, BCL6B, BAZ2A ALDH1A1 4832/4885MEN1 3321/4885KMT2A 1188/4885

“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.