SCHEMBL12123980

SCHEMBL12123980

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

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TFPI2 P48307 3/20 0.46
▸ PPP5C P53041 2/20 0.46
▸ PPP2CA P67775 1/20 0.46
▸ NPY4R P50391 1/20 0.46
▸ HTT P42858 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ TSHR P16473 1/20 0.36
▸ CYP1A2 P05177 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ HPGD P15428 1/20 0.31

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
SCHEMBL9881386 0.80 PPP5C (0.49) TFPI2PPP5CPPP2CANPY4RHTT
SCHEMBL9880146 0.80 TFPI2 (0.60) TFPI2PPP5CPPP2CANPY4RHTT
SCHEMBL9880162 0.79 PPP5C (0.48) TFPI2PPP5CPPP2CANPY4RHTT
SCHEMBL9880160 0.77 TSHR (0.54) TFPI2PPP5CPPP2CANPY4RHTT
SCHEMBL12124014 0.75 TFPI2 (0.66) TFPI2PPP5CPPP2CANPY4RHTT
SCHEMBL13556911 0.75 TFPI2 (0.66) TFPI2PPP5CPPP2CANPY4RHTT
SCHEMBL16731268 0.71 PPP5C (0.41) TFPI2PPP5CPPP2CANPY4RHTT
SCHEMBL9880171 0.70 PPP5C (0.39) TFPI2PPP5CPPP2CANPY4RHTT
SCHEMBL22863835 0.69 PPM1B (0.33) —
SCHEMBL10050922 0.69 — —

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-8058268-B2 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases LIXTE BIOTECHNOLOGY, INC. (US) 2011-11-15 — — US disclosed
US-20100029640-A1 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases LIXTE BIOTECHNOLOGY, INC. 2010-02-04 — — 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-20100029640-A1 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases SNCA, NLN, HTT TFPI2 4324/4885PPP5C 2709/4885PPP2CA 1893/4885

“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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