SCHEMBL5669072

SCHEMBL5669072

CCC12CC3CC(CC(C=C(C)C(=O)O)(C3)C1)C2

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2A Q12879 1/20 0.44
GRIN2B Q13224 1/20 0.44
GRIN2C Q14957 1/20 0.44
GRIN3A Q8TCU5 1/20 0.44
PKM P14618 1/20 0.43
ALDH1A1 P00352 4/20 0.38
GAA P10253 1/20 0.37
POLB P06746 1/20 0.36
ALOX15 P16050 1/20 0.36
DPP4 P27487 1/20 0.36
TSHR P16473 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL3680657 0.85 ALDH1A1 (0.35) PKMALDH1A1GAAPOLBTSHR
SCHEMBL3680655 0.85 ALDH1A1 (0.35) PKMALDH1A1GAAPOLBTSHR
SCHEMBL906381 0.80 PKM (0.38) PKMALDH1A1GAADPP4
SCHEMBL565526 0.80 PKM (0.38) PKMALDH1A1GAADPP4
SCHEMBL15152944 0.80 TSHR (0.41) ALDH1A1GAATSHR
SCHEMBL757168 0.78 THRB (0.39) ALDH1A1
SCHEMBL157720 0.78 THRB (0.39) ALDH1A1
SCHEMBL3876333 0.78 ALDH1A1 (0.47) PKMALDH1A1GAAMEN1KMT2A
SCHEMBL3788307 0.75 PGR (0.32)
SCHEMBL6365048 0.74 GLA (0.39) ALDH1A1POLBTSHRMEN1KMT2A

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
US-8980529-B2 Radiation-sensitive resin composition, polymer, and resist pattern-forming method JSR CORPORATION (JP) 2015-03-17 US disclosed
US-20130203000-A1 RADIATION-SENSITIVE RESIN COMPOSITION, POLYMER, AND RESIST PATTERN-FORMING METHOD JSR CORPORATION (JP) 2013-08-08 US disclosed
US-20060178457-A1 Optical members and polymerizable compositions and thio compounds for producing them FUJIFILM CORPORATION (JP) 2006-08-10 US disclosed
US-20060056786-A1 Optical members and compositions for producing them FUJIFILM CORPORATION (JP) 2006-03-16 US disclosed