SCHEMBL11235185

SCHEMBL11235185

O=C(O)[C@]1(Cc2ccc(Cl)cc2)CCCN1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.44
SLC6A4 P31645 6/20 0.44
SLC6A3 Q01959 6/20 0.44
HRH3 Q9Y5N1 4/20 0.44
ARG1 P05089 1/20 0.42
ARG2 P78540 1/20 0.42
CYP2D6 P10635 5/20 0.41
KCNH2 Q12809 1/20 0.41
PARP1 P09874 4/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL1817184 1.00 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3HRH3ARG1
Bromide SCHEMBL11268278 0.98 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3HRH3ARG1
SCHEMBL1819135 0.86 HRH3 (0.56) SLC6A2SLC6A4SLC6A3HRH3ARG1
SCHEMBL11234764 0.86 HRH3 (0.56) SLC6A2SLC6A4SLC6A3HRH3ARG1
SCHEMBL10956783 0.86 SLC6A2 (0.56) SLC6A2SLC6A4SLC6A3HRH3ARG1
SCHEMBL414249 0.86 SLC6A2 (0.56) SLC6A2SLC6A4SLC6A3HRH3ARG1
SCHEMBL440476 0.86 SLC6A2 (0.56) SLC6A2SLC6A4SLC6A3HRH3ARG1
SCHEMBL11242292 0.85 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3HRH3ARG1
SCHEMBL4849081 0.85 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3HRH3ARG1
SCHEMBL1818182 0.85 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3HRH3ARG1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113967258-B FAP-activated therapeutic agents and related uses 塔夫茨大学信托人 2024-07-02 CN disclosed
EP-0049589-A1 Carboxyalkanoyl and hydroxycarbamoylalkanoyl derivatives of substituted prolines E.R. Squibb & Sons, Inc. (US) 1982-04-14 EP disclosed
US-4316905-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1982-02-23 US disclosed
US-4311705-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1982-01-19 US disclosed