SCHEMBL9283784

SCHEMBL9283784

CC(C)(C)CN(CC(C)(C)C)C1CC1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 2/20 0.38
▸ SLC6A4 P31645 2/20 0.38
▸ SLC6A3 Q01959 2/20 0.38
▸ PIN1 Q13526 1/20 0.32

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
SCHEMBL9284811 0.87 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3
SCHEMBL8768114 0.87 CYP2D6 (0.39) SLC6A2SLC6A4SLC6A3
SCHEMBL9285301 0.83 DRD3 (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL9284842 0.83 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL9281011 0.81 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3
SCHEMBL21042887 0.81 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3PIN1
SCHEMBL9278394 0.79 ADH1C (0.34) SLC6A2SLC6A4SLC6A3
SCHEMBL24927577 0.78 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL9284267 0.78 ADH1A (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL8276873 0.77 PIN1 (0.32) PIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190077803-A1 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS INC (US) 2019-03-14 — — US disclosed
US-20170044160-A1 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS, INC. 2017-02-16 — — US disclosed
US-20170044160-A1 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS, INC. 2017-02-16 — — US disclosed
US-9315451-B2 Tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2016-04-19 — — US disclosed
US-20120135968-A1 Tetracycline Compounds TETRAPHASE PHARMACEUTICALS, INC. 2012-05-31 — — 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-20170044160-A1 TETRACYCLINE COMPOUNDS TUBB, TUBA1C, TUBA1A SLC6A2 1782/4885SLC6A4 1287/4885SLC6A3 1994/4885
US-20120135968-A1 Tetracycline Compounds TUBB, TUBA1C, TUBA1A SLC6A2 1782/4885SLC6A4 1287/4885SLC6A3 1994/4885
US-20190077803-A1 TETRACYCLINE COMPOUNDS TUBB, TUBA1C, TUBA1A SLC6A2 1782/4885SLC6A4 1287/4885SLC6A3 1994/4885

“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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