SCHEMBL444434

SCHEMBL444434

C[C@H](C[C@@H](O)/C=C\C=C/C=C/CO)[C@](C)(O)/C=C/[C@H]1CC=CC(=O)O1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPP4C P60510 1/20 0.73
MAPT P10636 2/20 0.70
TDP1 Q9NUW8 1/20 0.70
MEN1 O00255 1/20 0.36
JAK2 O60674 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
XPO1 O14980 1/20 0.32

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
SCHEMBL10731783 0.91 PPP4C (0.75) PPP4CMAPTTDP1MEN1JAK2
SCHEMBL10731774 0.91 PPP4C (0.75) PPP4CMAPTTDP1MEN1JAK2
SCHEMBL442794 0.91 PPP4C (0.75) PPP4CMAPTTDP1MEN1JAK2
Phosphoric Acid SCHEMBL31628217 0.86 PPP4C (0.76) PPP4CMAPTTDP1MEN1JAK2
SCHEMBL442224 0.86 PPP4C (0.77) PPP4CMAPTTDP1MEN1JAK2
SCHEMBL442761 0.86 PPP4C (0.67) PPP4CMAPTTDP1MEN1JAK2
Fostriecin SCHEMBL10738892 0.85 PPP4C (1.00) PPP4CMAPTTDP1MEN1JAK2
Fostriecin SCHEMBL469219 0.85 PPP4C (1.00) PPP4CMAPTTDP1MEN1JAK2
SCHEMBL444582 0.85 PPP4C (0.66) PPP4CMAPTTDP1MEN1JAK2
Fostriecin SCHEMBL10738899 0.85 PPP4C (1.00) PPP4CMAPTTDP1MEN1JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8623912-B2 Fostriecin derivatives and the pharmaceutical uses thereof BEIJING BIOSTAR TECHNOLOGIES, LTD. (CN) 2014-01-07 US disclosed
US-20120065171-A1 FOSTRIECIN DERIVATIVES AND THE PHARMACEUTICAL USES THEREOF DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2012-03-15 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-20120065171-A1 FOSTRIECIN DERIVATIVES AND THE PHARMACEUTICAL USES THEREOF FOS, FOSB, VIP PPP4C 1459/4885MAPT 4115/4885TDP1 3980/4885

“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.