SCHEMBL17830798

SCHEMBL17830798

C=c1s/c(=C2\C(=O)N(CC(=O)OCc3ccc(F)cc3)c3ccc(Cl)cc32)c(=O)n1CCC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
P2RX3 P56373 5/20 0.36
KAT2B Q92831 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33
CCKBR P32239 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
KDM4E B2RXH2 1/20 0.32
PTGER1 P34995 2/20 0.31
MDM2 Q00987 1/20 0.31
TBXA2R P21731 1/20 0.31
PTGER4 P35408 1/20 0.31
PTGER3 P43115 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
SCHEMBL17830799 0.95 ALDH1A1 (0.35) P2RX3CCKBRALDH1A1HPGDKDM4E
SCHEMBL17830794 0.93 CCKBR (0.38) KAT2BCCKBRALDH1A1HPGDKDM4E
SCHEMBL17830797 0.92 ALDH1A1 (0.37) P2RX3KAT2BALDH1A1KDM4E
SCHEMBL17830802 0.92 MDM2 (0.34) P2RX3CCKBRALDH1A1KDM4EMDM2
SCHEMBL17830793 0.90 PARK7 (0.37) MEN1KMT2ACTDSP1KAT2BPTGDR2
SCHEMBL17830801 0.87 HSP90AA1 (0.37) MEN1KMT2AP2RX3CCKBRALDH1A1
SCHEMBL17830803 0.85 PTPN7 (0.35) P2RX3KAT2BALDH1A1KDM4EMDM2
SCHEMBL17830796 0.83 ALDH1A1 (0.37) MEN1KMT2AALDH1A1
SCHEMBL17830795 0.81 ALDH1A1 (0.38) MEN1KMT2ACCKBRALDH1A1HPGD
SCHEMBL17830800 0.80 RECQL (0.36) P2RX3PTGDR2ALDH1A1MDM2

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 MEN1 3321/4885KMT2A 1188/4885CTDSP1 1710/4885

“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.