SCHEMBL8656249

SCHEMBL8656249

COC(=O)C(C)(CC(=O)O)CC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.59
CYP2C19 P33261 2/20 0.59
HIF1A Q16665 2/20 0.59
CYP2D6 P10635 1/20 0.59
HMGCR P04035 1/20 0.48
CHRM1 P11229 1/20 0.48
TBXA2R P21731 1/20 0.48
ADRA1A P35348 1/20 0.48
KDM4E B2RXH2 1/20 0.41
DGAT1 O75907 1/20 0.41
FFAR1 O14842 1/20 0.41
CPT2 P23786 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KCNN4 O15554 1/20 0.37
ALDH1A1 P00352 2/20 0.36
EGLN1 Q9GZT9 2/20 0.34
LDHA P00338 1/20 0.33
SRR Q9GZT4 1/20 0.33
SRC P12931 1/20 0.33
FFAR3 O14843 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
SCHEMBL11964743 0.88 CYP2C19 (0.52) TSHRCYP2C19HIF1ACYP2D6HMGCR
SCHEMBL161121 0.82 HMGCR (0.46) TSHRCYP2C19HIF1ACYP2D6HMGCR
SCHEMBL4628164 0.80 HMGCR (0.50) TSHRCYP2C19HIF1ACYP2D6HMGCR
SCHEMBL12716750 0.79 TSHR (0.46) TSHRCYP2C19HIF1ACYP2D6KDM4E
SCHEMBL25325252 0.78 HMGCR (0.42) TSHRCYP2C19HIF1ACYP2D6HMGCR
SCHEMBL9273476 0.78 HMGCR (0.42) TSHRCYP2C19HIF1ACYP2D6HMGCR
SCHEMBL442453 0.78 HMGCR (0.42) TSHRCYP2C19HIF1ACYP2D6HMGCR
SCHEMBL28439076 0.78 TSHR (0.46) TSHRCYP2C19HIF1ACYP2D6HMGCR
SCHEMBL17898147 0.78 CYP2D6 (0.42) TSHRCYP2C19HIF1ACYP2D6HMGCR
SCHEMBL2744420 0.77 ALDH1A1 (0.52) TSHRCYP2C19HIF1ACYP2D6HMGCR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0872526-A1 Transparent yellow powder paint MITA INDUSTRIAL CO. LTD. (JP) 1998-10-21 EP disclosed
EP-0856567-A2 A transparent powder paint and a method of forming a coated film toned by using the above powder paint MITA INDUSTRIAL CO. LTD. (JP) 1998-08-05 EP disclosed