SCHEMBL2332631

SCHEMBL2332631

O=C(O)C1C2CCC(O2)C1C(=O)N1CCN(C(=O)O)CC1

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TFPI2 P48307 11/20 0.77
PPP5C P53041 2/20 0.76
NPY4R P50391 2/20 0.76
PPP2CA P67775 1/20 0.76
KDM4E B2RXH2 1/20 0.61
GMNN O75496 1/20 0.61
LMNA P02545 1/20 0.61
PMP22 Q01453 1/20 0.61
TP53 P04637 1/20 0.61
TSHR P16473 1/20 0.61
NFKB1 P19838 1/20 0.61
THPO P40225 1/20 0.61
PPM1B O75688 2/20 0.47
PTPN1 P18031 2/20 0.47
PPP1CC P36873 2/20 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
SCHEMBL13311599 0.87 TFPI2 (0.93) TFPI2PPP5CNPY4RPPP2CAKDM4E
Lb-100 SCHEMBL13311584 0.86 TFPI2 (1.00) TFPI2PPP5CNPY4RPPP2CAKDM4E
Lb-100 SCHEMBL26377801 0.86 TFPI2 (1.00) TFPI2PPP5CNPY4RPPP2CAKDM4E
Lb-100 SCHEMBL12390164 0.86 TFPI2 (1.00) TFPI2PPP5CNPY4RPPP2CAKDM4E
Lb-100 SCHEMBL2832350 0.86 TFPI2 (1.00) TFPI2PPP5CNPY4RPPP2CAKDM4E
Lb-100 SCHEMBL9880148 0.86 TFPI2 (1.00) TFPI2PPP5CNPY4RPPP2CAKDM4E
Lb-100 SCHEMBL19512780 0.86 TFPI2 (1.00) TFPI2PPP5CNPY4RPPP2CAKDM4E
Lb-100 SCHEMBL19501013 0.86 TFPI2 (1.00) TFPI2PPP5CNPY4RPPP2CAKDM4E
SCHEMBL9880174 0.86 TFPI2 (0.90) TFPI2PPP5CNPY4RPPP2CAKDM4E
SCHEMBL18073223 0.86 TFPI2 (0.90) TFPI2PPP5CNPY4RPPP2CAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2124550-B1 OXABICYCLOHEPTANES AND OXABICYCLOHEPTENES, THEIR PREPARATION AND USE LIXTE BIOTECHNOLOGY INC (US) 2017-04-19 EP disclosed
US-9079917-B2 Oxabicycloheptanes and oxabicycloheptenes, their preparation and use LIXTE BIOTECHNOLOGY, INC. (US) 2015-07-14 US disclosed
US-20150045373-A1 OXABICYCLOHEPTANES AND OXABICYCLOHEPTENES, THEIR PREPARATION AND USE LIXTE BIOTECHNOLOGY, INC. 2015-02-12 US disclosed
US-8426444-B2 Oxabicycloheptanes and oxabicycloheptenes, their preparation and use LIXTE BIOTECHNOLOGY, INC. (US) 2013-04-23 US disclosed
US-20120270736-A1 OXABICYCLOHEPTANES AND OXABICYCLOHEPTENES, THEIR PREPARATION AND USE LIXTE BIOTECHNOLOGY, INC. (US) 2012-10-25 US disclosed
US-7998957-B2 Oxabicycloheptanes and oxabicylcoheptenes, their preparation and use LIXTE BIOTECHNOLOGY, INC. (US) 2011-08-16 US disclosed
US-20090036309-A1 Oxabicycloheptanes and oxabicylcoheptenes, their preparation and use LIXTE BIOTECHNOLOGY, INC. 2009-02-05 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 (3 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-20120270736-A1 OXABICYCLOHEPTANES AND OXABICYCLOHEPTENES, THEIR PREPARATION AND USE HCCS, OXA1L, OTC TFPI2 4858/4885PPP5C 3037/4885NPY4R 2937/4885
US-20150045373-A1 OXABICYCLOHEPTANES AND OXABICYCLOHEPTENES, THEIR PREPARATION AND USE HCCS, OXA1L, OTC TFPI2 4858/4885PPP5C 3037/4885NPY4R 2937/4885
US-20090036309-A1 Oxabicycloheptanes and oxabicylcoheptenes, their preparation and use HCCS, VHL, OXA1L TFPI2 4843/4885PPP5C 2860/4885NPY4R 3326/4885

“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.