SCHEMBL19003938

SCHEMBL19003938

CCC(C)C1CCCCCCCN1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 14/20 0.46
SLC6A4 P31645 14/20 0.46
SLC6A3 Q01959 14/20 0.46
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL12386910 1.00 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3HIF1AHSD17B10
SCHEMBL12386911 1.00 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3HIF1AHSD17B10
SCHEMBL19417440 0.98 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3HIF1AHSD17B10
SCHEMBL1547848 0.98 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3HIF1AHSD17B10
SCHEMBL11627963 0.91
SCHEMBL19958821 0.91
Methane SCHEMBL28084753 0.89 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3
SCHEMBL19250499 0.84
SCHEMBL9353322 0.82 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3
SCHEMBL18517104 0.79 SLC6A2 (0.40) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9789089-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2017-10-17 US disclosed
EP-2348125-B1 Method for the synthesis of a bifunctional complex NUEVOLUTION AS (DK) 2017-06-21 EP disclosed