SCHEMBL16731414

SCHEMBL16731414

CCCCC/C=C/C/C=C/CCCCCCCCOC(=O)C1C2C=CC(O2)C1C(=O)N1CCN(C)CC1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.37
▸ FAAH O00519 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ DUSP3 P51452 1/20 0.36
▸ PTPN7 P35236 1/20 0.36

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
SCHEMBL16731415 0.93 PPARG (0.39) ALDH1A1MAPTTHRB
SCHEMBL16731269 0.93 PPARG (0.39) ALDH1A1MAPTTHRB
SCHEMBL16731301 0.87 PPP5C (0.47) MGLLFAAHALDH1A1MAPTTHRB
SCHEMBL16731419 0.87 PPP5C (0.47) MGLLFAAHALDH1A1MAPTTHRB
SCHEMBL18047220 0.87 PPP5C (0.47) MGLLFAAHALDH1A1MAPTTHRB
SCHEMBL16731268 0.84 PPP5C (0.41) ALDH1A1
SCHEMBL16731299 0.76 TFPI2 (0.56) THRB
SCHEMBL17585970 0.76 TFPI2 (0.56) THRB
SCHEMBL26377846 0.76 TFPI2 (0.56) THRB
SCHEMBL16731276 0.76 TFPI2 (0.56) THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160264593-A1 PROTEIN PHOSPHATASE INHIBITORS THAT CROSS THE BLOOD BRAIN BARRIER LIXTE BIOTECHNOLOGY, INC. 2016-09-15 — — US disclosed
US-20160264593-A1 PROTEIN PHOSPHATASE INHIBITORS THAT CROSS THE BLOOD BRAIN BARRIER LIXTE BIOTECHNOLOGY, INC. 2016-09-15 — — US disclosed
WO-2015073802-A1 PROTEIN PHOSPHATASE INHIBITORS THAT CROSS THE BLOOD BRAIN BARRIER LIXTE BIOTECHNOLOGY, INC. (US) 2015-05-21 — — 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 (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-20160264593-A1 PROTEIN PHOSPHATASE INHIBITORS THAT CROSS THE BLOOD BRAIN BARRIER DUSP1, PPP5C, DUSP15 MGLL 1971/4885FAAH 940/4885ALDH1A1 2673/4885

“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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