SCHEMBL29322616

SCHEMBL29322616

CC(C=O)(C=O)C[C@H]1CNCCO1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.36
SLC6A3 Q01959 6/20 0.36
SLC6A4 P31645 6/20 0.36
HTR2A P28223 3/20 0.36
ADRB2 P07550 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA1A P35348 1/20 0.36
HTR2B P41595 1/20 0.36
ADRA2C P18825 1/20 0.36
SSTR4 P31391 5/20 0.35

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
SCHEMBL7297410 0.86 SLC6A2 (0.36) SLC6A2SLC6A3SLC6A4HTR2AADRB2
SCHEMBL29322818 0.82 SLC6A2 (0.35) SLC6A2SLC6A3SLC6A4HTR2AADRB2
SCHEMBL10308899 0.80 SLC6A2 (0.41) SLC6A2SLC6A3SLC6A4HTR2AADRB2
SCHEMBL23179776 0.80 SLC6A2 (0.41) SLC6A2SLC6A3SLC6A4HTR2AADRB2
SCHEMBL23179778 0.80 SLC6A2 (0.41) SLC6A2SLC6A3SLC6A4HTR2AADRB2
SCHEMBL31265606 0.77 SLC6A2 (0.39) SLC6A2SLC6A3SLC6A4HTR2AADRB2
SCHEMBL31265610 0.77 SLC6A2 (0.39) SLC6A2SLC6A3SLC6A4HTR2AADRB2
SCHEMBL7297402 0.76 SLC6A2 (0.36) SLC6A2SLC6A3SLC6A4HTR2AADRB2
SCHEMBL22625575 0.76 ADRA2C (0.41) SLC6A2SLC6A3SLC6A4HTR2AADRB2
SCHEMBL21200125 0.76 ADRA2C (0.41) SLC6A2SLC6A3SLC6A4HTR2AADRB2

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-20240239756-A1 NOVEL 3, 5-DISUBSTITUTED PYRIDINE AND 3, 5-DISUBSTITUTED PYRIDAZINE DERIVATIVES AND PHARMACEUTICAL USE OF SAME MITSUBISHI TANABE PHARMA CORPORATION (JP) 2024-07-18 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-20240239756-A1 NOVEL 3, 5-DISUBSTITUTED PYRIDINE AND 3, 5-DISUBSTITUTED PYRIDAZINE DERIVATIVES AND PHARMACEUTICAL USE OF SAME ENPP2, SSB, PLPBP SLC6A2 873/4885SLC6A3 959/4885SLC6A4 1136/4885

“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.