SCHEMBL19212472

SCHEMBL19212472

COC(CCCCCCCC(C)(C)O)OC

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
ACACB O00763 1/20 0.34
ACACA Q13085 1/20 0.34
SMPD1 P17405 3/20 0.31

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
SCHEMBL19248353 0.78 ALDH1A1 (0.33) ALDH1A1ACACBACACA
SCHEMBL7934735 0.78 SMPD1 (0.36) SMPD1
SCHEMBL7936797 0.78 SMPD1 (0.36) SMPD1
SCHEMBL7934687 0.78 SMPD1 (0.36) SMPD1
SCHEMBL5160133 0.78 SMPD1 (0.36) SMPD1
SCHEMBL6567377 0.78 SMPD1 (0.36) SMPD1
SCHEMBL8184105 0.77 RIPK1 (0.30)
SCHEMBL2943010 0.75 ALDH1A1 (0.64) ALDH1A1ACACBACACASMPD1
SCHEMBL2945318 0.75 ALDH1A1 (0.64) ALDH1A1ACACBACACASMPD1
SCHEMBL6298010 0.75 SMPD1 (0.32) SMPD1

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
EP-3414309-A1 FRAGRANCE COMPOSITIONS COMPRISING COMPOUNDS WITH OLFACTORY QUALITIES P2 Science, Inc. (US) 2018-12-19 EP disclosed
US-20180346844-A1 FRAGRANCE COMPOSITIONS COMPRISING COMPOUNDS WITH OLFACTORY QUALITIES P2 SCIENCE, INC. 2018-12-06 US disclosed
WO-2017139637-A1 FRAGRANCE COMPOSITIONS COMPRISING COMPOUNDS WITH OLFACTORY QUALITIES P2 SCIENCE, INC. (US) 2017-08-17 WO disclosed
WO-2017139637-A1 FRAGRANCE COMPOSITIONS COMPRISING COMPOUNDS WITH OLFACTORY QUALITIES P2 SCIENCE, INC. (US) 2017-08-17 WO disclosed