SCHEMBL23872913

SCHEMBL23872913

CC(C)(CC(C)(C)C(=O)OCC1CC2CC1C1CCCC21)C(=O)OCC1CC2CC1C1CCCC21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 2/20 0.34
MAPT P10636 3/20 0.32
CA12 O43570 2/20 0.32
GMNN O75496 2/20 0.32
ALDH1A1 P00352 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
LMNA P02545 2/20 0.32
BLM P54132 2/20 0.32
CA9 Q16790 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
SGMS1 Q86VZ5 1/20 0.32
SGMS2 Q8NHU3 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL16675023 0.90 HMGCR (0.43) HMGCRMAPTCA12GMNNALDH1A1
SCHEMBL20962040 0.86 MAPT (0.32) MAPTCA12GMNNALDH1A1CA1
SCHEMBL18222829 0.80 CHRM1 (0.40) MAPTCA12GMNNALDH1A1CA1
SCHEMBL16744319 0.80 HMGCR (0.31) HMGCR
SCHEMBL18222843 0.78 CHRM1 (0.34) MAPTCA12GMNNALDH1A1CA1
SCHEMBL10225080 0.77 SGMS1 (0.30) MAPTCA12GMNNALDH1A1CA1
SCHEMBL12641415 0.75 ALDH1A1 (0.44) MAPTCA12GMNNALDH1A1CA1
SCHEMBL14388481 0.75
SCHEMBL16744315 0.74 CHRM1 (0.35) MAPTCA12GMNNALDH1A1CA1
SCHEMBL14357743 0.74 ALDH1A1 (0.32) MAPTALDH1A1LMNAMEN1KMT2A

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
US-20210302712-A1 Immersion oils having long service life CARL ZEISS JENA GMBH (DE) 2021-09-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210302712-A1 Immersion oils having long service life DGKI, CCNE2, CYCS HMGCR 3119/4885MAPT 4048/4885CA12 1119/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.