SCHEMBL13311599

SCHEMBL13311599

O=C(O)C1C(C(=O)N2CCCC2)[C@H]2CC[C@@H]1O2

nearest known ligand 0.93

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TFPI2 P48307 11/20 0.93
PPP5C P53041 2/20 0.73
NPY4R P50391 2/20 0.73
PPP2CA P67775 1/20 0.73
LMNA P02545 2/20 0.63
KDM4E B2RXH2 1/20 0.63
GMNN O75496 1/20 0.63
PMP22 Q01453 1/20 0.63
TP53 P04637 1/20 0.63
TSHR P16473 1/20 0.63
NFKB1 P19838 1/20 0.63
THPO P40225 1/20 0.63
PPM1B O75688 1/20 0.49
PTPN1 P18031 1/20 0.49
PPP1CC P36873 1/20 0.49
PPP1CA P62136 1/20 0.47

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
SCHEMBL18073223 0.98 TFPI2 (0.90) TFPI2PPP5CNPY4RPPP2CALMNA
SCHEMBL13311562 0.98 TFPI2 (0.90) TFPI2PPP5CNPY4RPPP2CALMNA
SCHEMBL9880174 0.98 TFPI2 (0.90) TFPI2PPP5CNPY4RPPP2CALMNA
SCHEMBL2332631 0.87 TFPI2 (0.77) TFPI2PPP5CNPY4RPPP2CALMNA
SCHEMBL9880167 0.86 TFPI2 (0.75) TFPI2PPP5CNPY4RPPP2CALMNA
SCHEMBL13311565 0.86 TFPI2 (0.75) TFPI2PPP5CNPY4RPPP2CALMNA
Lb-100 SCHEMBL12390164 0.84 TFPI2 (1.00) TFPI2PPP5CNPY4RPPP2CALMNA
SCHEMBL13311572 0.84 TFPI2 (0.73) TFPI2PPP5CNPY4RPPP2CALMNA
SCHEMBL2334396 0.84 TFPI2 (0.73) TFPI2PPP5CNPY4RPPP2CALMNA
Lb-100 SCHEMBL9880148 0.84 TFPI2 (1.00) TFPI2PPP5CNPY4RPPP2CALMNA

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-20100137294-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR CONTROLLING INVERTEBRATE PESTS GENETIC TECHNOLOGIES LIMITED (AU) 2010-06-03 US disclosed
US-20100137294-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR CONTROLLING INVERTEBRATE PESTS GENETIC TECHNOLOGIES LIMITED (AU) 2010-06-03 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-20100137294-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR CONTROLLING INVERTEBRATE PESTS PPP1R10, TASP1, PPP5C TFPI2 1086/4885PPP5C 3/4885NPY4R 4799/4885

“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.