SCHEMBL31496727

SCHEMBL31496727

CC(C)(C)OC(=O)NCCN1CCN(CCN)CC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.56
CACNA1H O95180 1/20 0.55
SIGMAR1 Q99720 2/20 0.46
TDP1 Q9NUW8 1/20 0.45
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GFER P55789 1/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
CD274 Q9NZQ7 1/20 0.43

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
Hydrochloric Acid SCHEMBL25170707 0.98 DRD2 (0.55) DRD2CACNA1HSIGMAR1TDP1MAOA
SCHEMBL31301242 0.92 DRD2 (0.63) DRD2CACNA1HSIGMAR1TDP1ALDH1A1
SCHEMBL13202614 0.87 DRD2 (0.59) DRD2CACNA1HSIGMAR1TDP1ALDH1A1
SCHEMBL5324032 0.86 DRD2 (0.57) DRD2CACNA1HSIGMAR1TDP1ALDH1A1
SCHEMBL18390128 0.86 DRD2 (0.57) DRD2CACNA1HSIGMAR1TDP1ALDH1A1
SCHEMBL31301250 0.85 DRD2 (0.56) DRD2CACNA1HSIGMAR1TDP1MEN1
SCHEMBL24172673 0.85 DRD2 (0.56) DRD2CACNA1HSIGMAR1TDP1MEN1
SCHEMBL4024516 0.85 DRD2 (0.56) DRD2CACNA1HTDP1MEN1GAA
SCHEMBL18824244 0.85 DRD2 (0.54) DRD2CACNA1HSIGMAR1TDP1MAOA
SCHEMBL11014476 0.85 DRD2 (0.58) DRD2CACNA1HSIGMAR1TDP1MAOA

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-12491262-B2 Gene delivery agents TIBA BIOTECH LLC (US) 2025-12-09 US disclosed
WO-2025096681-A1 NOVEL GENE DELIVERY AGENTS TIBA BIOTECH LLC (US) 2025-05-08 WO disclosed
US-20250144233-A1 NOVEL GENE DELIVERY AGENTS TIBA BIOTECH LLC 2025-05-08 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 (2 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-12491262-B2 Gene delivery agents TSG101, TLR3, TLR9 DRD2 4817/4885CACNA1H 4358/4885SIGMAR1 3047/4885
US-20250144233-A1 NOVEL GENE DELIVERY AGENTS TSG101, STING1, TLR3 DRD2 4815/4885CACNA1H 4540/4885SIGMAR1 2945/4885

“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.