SCHEMBL18967973

SCHEMBL18967973

CC(C)(O)CC(=O)OC(C)(C)CO

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.36
HMGCR P04035 1/20 0.32
CHRM1 P11229 1/20 0.32
TBXA2R P21731 1/20 0.32
ADRA1A P35348 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
SCHEMBL11668547 0.82
SCHEMBL10339935 0.78 PIK3CD (0.40) PIK3CDHMGCRCHRM1TBXA2RADRA1A
SCHEMBL27912734 0.78 TSHR (0.39) ADRA1A
SCHEMBL17199778 0.77 ALDH1A1 (0.54) HMGCRCHRM1TBXA2RADRA1A
SCHEMBL9635053 0.76 ALDH1A1 (0.35)
SCHEMBL28098710 0.74 KDM4E (0.31)
Ammonia Solution, Strong SCHEMBL4621609 0.74 ALDH1A1 (0.33)
SCHEMBL17353334 0.72 GAA (0.33)
SCHEMBL16883005 0.71 EGLN1 (0.43) HMGCRCHRM1TBXA2RADRA1A
SCHEMBL585604 0.70

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-1720065-B1 Photosensitive lithographic printing plate FUJIFILM CORP (JP) 2017-06-14 EP disclosed