SCHEMBL20794890

SCHEMBL20794890

CCc1ccc(CCCc2ccccc2-c2cc3cc(O)c(O)cc3c(=O)o2)cc1-c1cc2cc(O)c(O)cc2c(=O)o1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.36
SLC9A1 P19634 1/20 0.35
CNR1 P21554 4/20 0.35
CNR2 P34972 4/20 0.35
NR1H3 Q13133 1/20 0.33
MEN1 O00255 3/20 0.33
POLB P06746 3/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
APAF1 O14727 1/20 0.33
STAT6 P42226 1/20 0.33
HTT P42858 1/20 0.33
HIF1A Q16665 1/20 0.33
HSP90AA1 P07900 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 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
SCHEMBL20795012 0.89 ALOX5 (0.35) ALOX5SLC9A1CNR1CNR2MEN1
SCHEMBL17128869 0.87 ALOX5 (0.45) ALOX5SLC9A1MEN1POLBKMT2A
SCHEMBL17128865 0.86 MEN1 (0.41) ALOX5CNR1CNR2MEN1POLB
SCHEMBL17128864 0.83 ALOX5 (0.42) ALOX5CNR1CNR2MEN1POLB
SCHEMBL17128801 0.74 MEN1 (0.43) ALOX5MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL17128796 0.73 ALDH1A1 (0.46) ALOX5CNR1CNR2MEN1POLB
SCHEMBL17128794 0.73 MAPT (0.46) ALOX5CNR1CNR2NR1H3MEN1
SCHEMBL20976923 0.72 PTGES (0.35) ALOX5MEN1POLBKMT2AMAPT
SCHEMBL17128795 0.72 MAPT (0.48) ALOX5CNR1CNR2NR1H3MEN1
SCHEMBL17128791 0.72 ATM (0.51) ALOX5SLC9A1MEN1POLBKMT2A

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-20190071410-A1 3-Phenyl-7-Hydroxy-Isocoumarins as Macrophage Migration Inhibitory Factor (MIF) Inhibitors THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, AND THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2019-03-07 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-20190071410-A1 3-Phenyl-7-Hydroxy-Isocoumarins as Macrophage Migration Inhibitory Factor (MIF) Inhibitors MIF, CCL2, MMP12 ALOX5 1464/4885SLC9A1 4022/4885CNR1 4196/4885

“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.