SCHEMBL14639895

SCHEMBL14639895

CC[C@@]12CCOC([C@H](n3cc(C)c(=O)[nH]c3=O)O1)[C@H]2O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
ALB P02768 1/20 0.43
POLB P06746 1/20 0.43
ADRA1A P35348 1/20 0.43
BLM P54132 1/20 0.43
TK1 P04183 5/20 0.43
TYMP P19971 5/20 0.41

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
SCHEMBL24263989 0.91 TK1 (0.46) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL5996943 0.91 TK1 (0.46) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL26735103 0.91 TK1 (0.46) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL26738168 0.91 TK1 (0.46) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL26735099 0.89 ALDH1A1 (0.40) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL14929221 0.89 ALDH1A1 (0.44) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL14946304 0.89 ALDH1A1 (0.44) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL12740554 0.88 ALDH1A1 (0.40) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL12740463 0.88 ALDH1A1 (0.40) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL12015161 0.86 TK1 (0.40) ALDH1A1LMNAALBPOLBADRA1A

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
US-20230348522-A1 METHOD FOR PRODUCING BICYCLIC PHOSPHORAMIDITE DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-11-02 US disclosed
US-20070009897-A1 Method of detecting genetic polymorphism SANKYO COMPANY, LIMITED (JP) 2007-01-11 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 (2 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-20070009897-A1 Method of detecting genetic polymorphism DCLRE1B, ENY2, ENPP3 ALDH1A1 2007/4885LMNA 667/4885ALB 4853/4885
US-20230348522-A1 METHOD FOR PRODUCING BICYCLIC PHOSPHORAMIDITE PFAS, ENPP1, NAAA ALDH1A1 2704/4885LMNA 1660/4885ALB 1647/4885

“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.