SCHEMBL317324

SCHEMBL317324

COC(=O)[C@H]1CCC[C@H]1c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.76
SLC6A4 P31645 4/20 0.76
SLC6A3 Q01959 6/20 0.62
KCNQ3 O43525 1/20 0.54
KCNQ2 O43526 1/20 0.54
ATM Q13315 1/20 0.49

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
SCHEMBL15862963 1.00 SLC6A2 (0.76) SLC6A2SLC6A4SLC6A3KCNQ3KCNQ2
SCHEMBL10037559 1.00 SLC6A2 (0.76) SLC6A2SLC6A4SLC6A3KCNQ3KCNQ2
SCHEMBL29174152 0.97 SLC6A2 (0.81) SLC6A2SLC6A4SLC6A3KCNQ3KCNQ2
SCHEMBL12354221 0.97 SLC6A2 (0.81) SLC6A2SLC6A4SLC6A3KCNQ3KCNQ2
SCHEMBL17712999 0.90 SLC6A3 (0.66) SLC6A2SLC6A4SLC6A3ATM
SCHEMBL14405112 0.84 SLC6A3 (0.59) SLC6A2SLC6A4SLC6A3ATM
SCHEMBL15800131 0.83 MAPT (0.65) SLC6A2SLC6A4SLC6A3KCNQ3KCNQ2
SCHEMBL1223719 0.81 HDAC4 (0.61) SLC6A2SLC6A4SLC6A3ATM
SCHEMBL2504396 0.81 HDAC4 (0.61) SLC6A2SLC6A4SLC6A3ATM
SCHEMBL29451691 0.81 HDAC4 (0.61) SLC6A2SLC6A4SLC6A3ATM

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-8092720-B2 Polymer-supported metal complex catalyst NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2012-01-10 US disclosed
US-8092720-B2 Polymer-supported metal complex catalyst NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2012-01-10 US disclosed
US-8092720-B2 Polymer-supported metal complex catalyst NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2012-01-10 US disclosed
US-20090227743-A1 POLYMER-SUPPORTED METAL COMPLEX CATALYST NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2009-09-10 US disclosed
US-20090227743-A1 POLYMER-SUPPORTED METAL COMPLEX CATALYST NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2009-09-10 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-20090227743-A1 POLYMER-SUPPORTED METAL COMPLEX CATALYST PYM1, ARG1, SCO2 SLC6A2 3734/4885SLC6A4 4026/4885SLC6A3 3225/4885

“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.