SCHEMBL22009149

SCHEMBL22009149

C/C(=C\[C@@H]1CNCCO1)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.33
SLC6A2 P23975 3/20 0.32
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL3693503 0.85 SLC6A2 (0.33) SSTR4SLC6A2SLC6A4
SCHEMBL3686635 0.85 SLC6A2 (0.33) SSTR4SLC6A2SLC6A4
SCHEMBL19387694 0.80 DRD2 (0.31) SSTR4
SCHEMBL9235040 0.80 DRD2 (0.31) SSTR4
SCHEMBL28149922 0.79 SLC6A2 (0.32) SSTR4SLC6A2SLC6A4
SCHEMBL28500314 0.79 GLO1 (0.33) SSTR4SLC6A2SLC6A4SLC6A3
SCHEMBL1394143 0.77 ALDH1A1 (0.36)
SCHEMBL4309465 0.77 ALDH1A1 (0.36)
SCHEMBL28199175 0.77 SSTR4 (0.31) SSTR4
SCHEMBL6039637 0.74 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3

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
EP-3122747-B1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS NORTH & SOUTH BROTHER PHARMACY INVESTMENT CO LTD (CN) 2020-05-20 EP disclosed