SCHEMBL7833773

SCHEMBL7833773

CCC(C)(C)OC([O])CC(C)C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL6019035 0.78
SCHEMBL5961122 0.78 TSHR (0.39) ALDH1A1TSHRTDP1
SCHEMBL4393765 0.75
SCHEMBL5961011 0.74 ALDH1A1 (0.36) ALDH1A1TSHRTDP1
SCHEMBL5961063 0.71 CA2 (0.35) ALDH1A1TSHRTDP1
SCHEMBL5961008 0.70 ZDHHC7 (0.36) ALDH1A1TSHRTDP1
SCHEMBL3146943 0.69
SCHEMBL22641704 0.69 TSHR (0.45) ALDH1A1TSHRTDP1
SCHEMBL14535389 0.69
SCHEMBL4222254 0.69 ALDH1A1 (0.39) ALDH1A1TSHRTDP1

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-0858318-B1 COSMETIC PREPARATIONS CONTAINING PHOTOSTABLE UV-A FILTERS BASF AG (DE) 2001-06-06 EP disclosed