SCHEMBL12124014

SCHEMBL12124014

CN1CCN(C(=O)C2C(C=O)[C@H]3CC[C@@H]2O3)CC1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TFPI2 P48307 7/20 0.66
▸ PPP5C P53041 2/20 0.66
▸ PPP2CA P67775 1/20 0.66
▸ NPY4R P50391 1/20 0.66
▸ HTT P42858 1/20 0.41
▸ LMNA P02545 2/20 0.40
▸ TSHR P16473 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ GMNN O75496 1/20 0.35
▸ PMP22 Q01453 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ THPO P40225 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.35
▸ CTSB P07858 1/20 0.33
▸ CTSS P25774 1/20 0.33
▸ CTSK P43235 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
SCHEMBL13556911 1.00 TFPI2 (0.66) TFPI2PPP5CPPP2CANPY4RHTT
SCHEMBL12443570 0.82 TFPI2 (0.48) TFPI2PPP5CPPP2CANPY4RLMNA
SCHEMBL13477150 0.82 TFPI2 (0.48) TFPI2PPP5CPPP2CANPY4RLMNA
Lb-100 SCHEMBL13311584 0.80 TFPI2 (1.00) TFPI2PPP5CPPP2CANPY4RHTT
Lb-100 SCHEMBL19512780 0.80 TFPI2 (1.00) TFPI2PPP5CPPP2CANPY4RHTT
SCHEMBL9881182 0.80 TFPI2 (0.71) TFPI2PPP5CPPP2CANPY4RHTT
Lb-100 SCHEMBL12390164 0.80 TFPI2 (1.00) TFPI2PPP5CPPP2CANPY4RHTT
Lb-100 SCHEMBL26377801 0.80 TFPI2 (1.00) TFPI2PPP5CPPP2CANPY4RHTT
Lb-100 SCHEMBL9880148 0.80 TFPI2 (1.00) TFPI2PPP5CPPP2CANPY4RHTT
Lb-100 SCHEMBL2832350 0.80 TFPI2 (1.00) TFPI2PPP5CPPP2CANPY4RHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120270736-A1 OXABICYCLOHEPTANES AND OXABICYCLOHEPTENES, THEIR PREPARATION AND USE LIXTE BIOTECHNOLOGY, INC. (US) 2012-10-25 — — US disclosed
US-8058268-B2 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases LIXTE BIOTECHNOLOGY, INC. (US) 2011-11-15 — — US disclosed
US-7998957-B2 Oxabicycloheptanes and oxabicylcoheptenes, their preparation and use LIXTE BIOTECHNOLOGY, INC. (US) 2011-08-16 — — US disclosed
US-20100029640-A1 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases LIXTE BIOTECHNOLOGY, INC. 2010-02-04 — — US disclosed
US-20100029683-A1 Methods for regulating cell mitosis by inhibiting serine/threonine phosphateses LIXTE BIOTECHNOLOGY, INC. 2010-02-04 — — US disclosed
WO-2009020565-A1 USE OF PHOSPHATES TO TREAT NEUROBLASTOMAS AND MEDULLOGASTOMAS LIXTE BIOTECHNOLOGY, INC. (US) 2009-02-12 — — WO disclosed
US-20090036309-A1 Oxabicycloheptanes and oxabicylcoheptenes, their preparation and use LIXTE BIOTECHNOLOGY, INC. 2009-02-05 — — US disclosed
US-20090035292-A1 Use of phosphatases to treat neuroblastomas and medulloblastomas LIXTE BIOTECHNOLOGY, INC. 2009-02-05 — — US disclosed
WO-2008097561-A1 OXABICYCLOHEPTANES AND OXABICYCLOHEPTENES, THEIR PREPARATION AND USE LIXTE BIOTECHOLOGY HOLDINGS, INC. (US) 2008-08-14 — — WO 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 (5 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-20100029640-A1 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases SNCA, NLN, HTT TFPI2 4324/4885PPP5C 2709/4885PPP2CA 1893/4885
US-20100029683-A1 Methods for regulating cell mitosis by inhibiting serine/threonine phosphateses PSPH, PPP5C, BUB1B TFPI2 2409/4885PPP5C 2/4885PPP2CA 73/4885
US-20120270736-A1 OXABICYCLOHEPTANES AND OXABICYCLOHEPTENES, THEIR PREPARATION AND USE HCCS, OXA1L, OTC TFPI2 4858/4885PPP5C 3037/4885PPP2CA 2107/4885
US-20090036309-A1 Oxabicycloheptanes and oxabicylcoheptenes, their preparation and use HCCS, VHL, OXA1L TFPI2 4843/4885PPP5C 2860/4885PPP2CA 2048/4885
US-20090035292-A1 Use of phosphatases to treat neuroblastomas and medulloblastomas PPME1, PNKP, PPP6C TFPI2 4590/4885PPP5C 9/4885PPP2CA 20/4885

“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.

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