SCHEMBL23665153

SCHEMBL23665153

CC(C)CN(C(=O)CO)[C@@H]1CCNC1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 0.58
SLC6A4 P31645 20/20 0.58
SLC6A3 Q01959 16/20 0.58
KCNH2 Q12809 9/20 0.56
OPRK1 P41145 1/20 0.53
CYP2D6 P10635 1/20 0.50

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
SCHEMBL17043097 0.87 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3KCNH2OPRK1
SCHEMBL30948781 0.84 SLC6A2 (0.58) SLC6A2SLC6A4SLC6A3KCNH2OPRK1
SCHEMBL34474393 0.78 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3KCNH2OPRK1
SCHEMBL966031 0.77 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3KCNH2OPRK1
SCHEMBL27707181 0.76 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3KCNH2OPRK1
SCHEMBL21606459 0.75 PIK3CD (0.65) SLC6A2SLC6A4SLC6A3KCNH2OPRK1
SCHEMBL18872575 0.74 SLC6A4 (0.46) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL16408232 0.74 SLC6A4 (0.46) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL16408333 0.74 SLC6A4 (0.46) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL4634809 0.74 SLC6A2 (0.78) SLC6A2SLC6A4SLC6A3KCNH2OPRK1

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-20210221796-A1 ANTIBACTERIAL COMPOUNDS BLACKSMITH MEDICINES, INC. 2021-07-22 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-20210221796-A1 ANTIBACTERIAL COMPOUNDS SPOUT1, MRPL21, NRDC SLC6A2 3942/4885SLC6A4 4383/4885SLC6A3 3390/4885

“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.