SCHEMBL21541573

SCHEMBL21541573

CCC(O)(C=O)CCCC(C)C=O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.32
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL28157503 0.77 FDPS (0.35) TSHR
SCHEMBL11765289 0.76 CTSK (0.33) CTSKTP53TSHR
SCHEMBL579648 0.76 CTSK (0.33) CTSK
SCHEMBL3885021 0.75 ALDH1A1 (0.39) CTSKTP53TSHR
SCHEMBL31412818 0.75 ALDH1A1 (0.39) CTSKTP53TSHR
SCHEMBL3885024 0.75 ALDH1A1 (0.39) CTSKTP53TSHR
SCHEMBL27985743 0.74 SMPD1 (0.46)
SCHEMBL11762792 0.73 TP53 (0.34) CTSKTP53TSHR
SCHEMBL2925266 0.72
SCHEMBL11864337 0.72 CTSK (0.33) CTSK

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-3326659-B1 AN ABSORBENT ARTICLE COMPRISING AN ODOR CONTROL MIXTURE TOILETRY SALES LTD (GB) 2019-11-13 EP claimed