SCHEMBL4551699

SCHEMBL4551699

CCCCC(N)n1ccc(=O)[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
CRBN Q96SW2 3/20 0.41
GPR84 Q9NQS5 2/20 0.37
ALDH1A1 P00352 1/20 0.35
CYP2C19 P33261 1/20 0.35
DDB1 Q16531 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
DUT P33316 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
SCHEMBL19187027 0.84 CRBN (0.43) PKMCRBNGPR84ALDH1A1CYP2C19
SCHEMBL24023212 0.83 PKM (0.42) PKMCRBNGPR84ALDH1A1CYP2C19
SCHEMBL17394619 0.81 PKM (0.41) PKMCRBNGPR84ALDH1A1CYP2C19
SCHEMBL22327126 0.78 GPR84 (0.44) PKMCRBNGPR84ALDH1A1CYP2C19
SCHEMBL18479912 0.78 GPR84 (0.44) PKMCRBNGPR84ALDH1A1CYP2C19
SCHEMBL10598535 0.78 PKM (0.38) PKMCRBNALDH1A1CYP2C19DUT
SCHEMBL16289906 0.77 CRBN (0.40) PKMCRBNALDH1A1DDB1DUT
SCHEMBL23621035 0.77 ALDH1A1 (0.54) PKMCRBNGPR84ALDH1A1CYP2C19
SCHEMBL19612731 0.77 PKM (0.38) PKMCRBNGPR84ALDH1A1CYP2C19
SCHEMBL23620741 0.76 GPR84 (0.42) PKMCRBNGPR84ALDH1A1CYP2C19

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-7582748-B2 efficient synthetic route to an optionally protected 1-halo-2-deoxyribose; formation of an alkyl acetal, such as a methyl acetal, of a furanose, such as 2-deoxyribose, optionally protecting the remaining hydroxyl groups of the furanose, reacting the acetal with an acyl halide that forms the acid halide MICROBIOLOGICA QUIMICA E FARMACEUTICAL LTD. (BR) 2009-09-01 US disclosed
EP-1745573-A2 METHODS OF MANUFACTURE OF 2 -DEOXY-&bgr;-L-NUCLEOSIDES Microbiologica Quimica E Farmaceutica Ltd. (BR) 2007-01-24 EP disclosed
US-20040266996-A1 Methods of manufacture of 2'-deoxy-beta-L-nucleosides MICROBIOLOGICA QUIMICA E FARMACEUTICA LTD. (BR) 2004-12-30 US disclosed
WO-2004084453-A2 METHODS OF MANUFACTURE OF 2'-DEOXY-β-L-NUCLEOSIDES MICROBIOLOGICA QUIMICA E FARMACEUTICA LTD. (BR) 2004-09-30 WO 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-20040266996-A1 Methods of manufacture of 2'-deoxy-beta-L-nucleosides DUT, DAO, DCTD PKM 3017/4885CRBN 4719/4885GPR84 4024/4885

“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.