SCHEMBL21067306

SCHEMBL21067306

CC(C)C[C@@H](N)C(=O)N(Cc1cccc(Cl)c1)C(=O)[C@@H]1CCCN1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 17/20 0.49
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SCN4A P35499 1/20 0.39

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
SCHEMBL21067747 0.87 GHSR (0.49) GHSR
SCHEMBL21067852 0.86 GHSR (0.44) GHSRALDH1A1GAAL3MBTL1SCN4A
SCHEMBL21067674 0.80 F2 (0.39) SCN4A
SCHEMBL21067717 0.78 GHSR (0.49) GHSRSLC6A2SLC6A4SLC6A3SCN4A
SCHEMBL21067757 0.76 CTSC (0.47) GHSRSCN4A
SCHEMBL21067420 0.76 DPP4 (0.43) GHSRSLC6A2SLC6A3SCN4A
SCHEMBL1369574 0.74 SLC7A5 (0.35) SCN4A
SCHEMBL27544516 0.69 CTSC (0.41) GHSR
SCHEMBL10791037 0.69 CTSC (0.47) GHSRSCN4A
Hydrochloric Acid SCHEMBL27584408 0.69 F2 (0.41) GHSR

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-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed
US-20210254056-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION 2021-08-19 US disclosed
US-20190192691-A1 REGULATED BIOCIRCUIT SYSTEMS OBSIDIAN THERAPEUTICS, INC. 2019-06-27 US disclosed