SCHEMBL462872

SCHEMBL462872

CCOP(=O)(CC)N1CCC(N)CC1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
GNAI3 P08754 2/20 0.33
GNAO1 P09471 2/20 0.33
GNAI1 P63096 2/20 0.33
TP53 P04637 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL15443876 0.80 GNAI3 (0.33) TSHRGNAI3GNAO1GNAI1TP53
SCHEMBL31638412 0.71 GNAI3 (0.40) TSHRGNAI3GNAO1GNAI1TP53
SCHEMBL30399713 0.70 TSHR (0.45) TSHRGNAI3GNAO1GNAI1
SCHEMBL31638118 0.69 GNAI3 (0.45) TSHRGNAI3GNAO1GNAI1
SCHEMBL29012623 0.68 GNAI3 (0.44) TSHRGNAI3GNAO1GNAI1
SCHEMBL31638212 0.67 GNAI3 (0.50) TSHRGNAI3GNAO1GNAI1
SCHEMBL4622935 0.66 GNAI3 (0.53) TSHRGNAI3GNAO1GNAI1
SCHEMBL29012621 0.66 GNAI3 (0.49) TSHRGNAI3GNAO1GNAI1
SCHEMBL409726 0.65
SCHEMBL22001207 0.64

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-20120065169-A1 OLIGONUCLEOTIDE ANALOGUES HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2012-03-15 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-20120065169-A1 OLIGONUCLEOTIDE ANALOGUES HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS NSUN2, UPF1, RTCB TSHR 2993/4885GNAI3 2137/4885GNAO1 3033/4885

“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.