SCHEMBL11419082

SCHEMBL11419082

C=CCC(CCC)(CCC)NC(N)=O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL28428751 0.96 HTT (0.32) HTTALDH1A1LMNAHSD17B10
SCHEMBL11412698 0.82 LMNA (0.39) ALDH1A1LMNAHSD17B10
SCHEMBL11407799 0.80 ALDH1A1 (0.31) ALDH1A1
SCHEMBL28832185 0.78 LMNA (0.36) ALDH1A1LMNAHSD17B10
SCHEMBL28108722 0.78
SCHEMBL10875370 0.76 HTT (0.33) HTT
SCHEMBL28731336 0.74 TSHR (0.31)
SCHEMBL9169336 0.72 HTT (0.35) HTTALDH1A1
SCHEMBL11407135 0.72 TSHR (0.34) ALDH1A1LMNAHSD17B10
Fumaric Acid SCHEMBL11429944 0.71 L3MBTL1 (0.36)

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-4223041-A Urea derivatives to treat anxiety and aggressivity LABAZ (FR) 1980-09-16 US disclosed