SCHEMBL9050010

SCHEMBL9050010

C1CCCOCOCCCCCOCC1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.67
TSHR P16473 2/20 0.39
TTR P02766 1/20 0.39

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
SCHEMBL11741977 1.00 ALDH1A1 (0.67) ALDH1A1TSHRTTR
SCHEMBL1890967 0.96 ALDH1A1 (0.61) ALDH1A1TSHRTTR
SCHEMBL8720707 0.96 ALDH1A1 (0.61) ALDH1A1TSHRTTR
SCHEMBL3419841 0.96 ALDH1A1 (0.61) ALDH1A1TSHRTTR
SCHEMBL4788084 0.96 ALDH1A1 (0.58) ALDH1A1TSHRTTR
SCHEMBL1080336 0.96
SCHEMBL8384141 0.96 ALDH1A1 (0.58) ALDH1A1TSHRTTR
SCHEMBL8387990 0.96 ALDH1A1 (0.58) ALDH1A1TSHRTTR
SCHEMBL11788532 0.96 ALDH1A1 (0.58) ALDH1A1TSHRTTR
SCHEMBL8387818 0.96 ALDH1A1 (0.58) ALDH1A1TSHRTTR

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-0369733-B1 Fluorescent indicator dyes for alkali metal cations, their preparation and use UNIV CALIFORNIA (US) 1996-02-21 EP claimed