SCHEMBL6949185

SCHEMBL6949185

C=CCC1(S)CC2CCC1(C)C2(C)C

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A1 P30531 1/20 0.30
SLC6A12 P48065 1/20 0.30
SLC6A11 P48066 1/20 0.30

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
SCHEMBL28314893 0.76 NR3C1 (0.35) SLC6A1SLC6A12SLC6A11
SCHEMBL3914285 0.76 NR3C1 (0.35) SLC6A1SLC6A12SLC6A11
SCHEMBL3914283 0.76 NR3C1 (0.35) SLC6A1SLC6A12SLC6A11
SCHEMBL6944583 0.72 APOBEC3A (0.30)
SCHEMBL1176729 0.70
SCHEMBL28688971 0.69 PLA2G1B (0.33) SLC6A1SLC6A12SLC6A11
SCHEMBL11825501 0.69 PLA2G1B (0.33) SLC6A1SLC6A12SLC6A11
SCHEMBL8358195 0.66 L3MBTL1 (0.32) SLC6A1SLC6A12SLC6A11
SCHEMBL8358193 0.66 L3MBTL1 (0.32) SLC6A1SLC6A12SLC6A11
SCHEMBL3920696 0.66 NR3C1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030203915-A1 Nitric oxide donors, compositions and methods of use related applications NICOX S.A. (FR) 2003-10-30 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-20030203915-A1 Nitric oxide donors, compositions and methods of use related applications NOS1, NOS2, NOS3 SLC6A1 1797/4885SLC6A12 2040/4885SLC6A11 1748/4885

“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.