SCHEMBL4269487

SCHEMBL4269487

CCCC[C@](C)(N)C(=O)OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
CYP2C9 P11712 2/20 0.40
LMNA P02545 2/20 0.40
ALB P02768 1/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
MCHR1 Q99705 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
F2 P00734 2/20 0.36
PRSS1 P07477 2/20 0.36
PRSS2 P07478 2/20 0.36
PRSS3 P35030 2/20 0.36
PLAU P00749 1/20 0.35
HPN P05981 1/20 0.35
GAA P10253 1/20 0.35
ENPP1 P22413 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL4344157 0.80 ALDH1A1 (0.43) ALDH1A1LMNAKMT2AMEN1F2
SCHEMBL5724458 0.77 ALDH1A1 (0.47) ALDH1A1CYP2C9LMNAKMT2AMEN1
SCHEMBL6255019 0.76 BLM (0.51) ALDH1A1TDP1KDM4EKMT2AMEN1
SCHEMBL9982800 0.76 ALDH1A1 (0.49) ALDH1A1LMNATSHRKMT2AMEN1
SCHEMBL7586365 0.76 ALDH1A1 (0.46) ALDH1A1LMNAKMT2AMEN1SMN1; SMN2
SCHEMBL22832212 0.75 SMN1; SMN2 (0.38) ALDH1A1CYP2C9LMNAALBTSHR
Ammonia Solution, Strong SCHEMBL2836007 0.75 ALDH1A1 (0.47) ALDH1A1LMNATSHRKMT2AMEN1
SCHEMBL2227741 0.75 ALDH1A1 (0.47) ALDH1A1LMNATSHRKMT2AMEN1
SCHEMBL8713527 0.74 ALDH1A1 (0.41) ALDH1A1CYP2C9LMNAALBTSHR
SCHEMBL27659885 0.74 ALDH1A1 (0.47) ALDH1A1CYP2C9LMNAALBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1928475-B1 ANTIVIRAL PHOSPHORAMIDATES OF 4'-C-AZIDO-SUBSTITUTED PRONUCLEOTIDES RIBOSCIENCE LLC (US) 2018-05-23 EP disclosed
US-7608599-B2 Antiviral phosphoramidates ROCHE PALO ALTO LLC (US) 2009-10-27 US disclosed
US-20070042988-A1 Antiviral phosphoramidates ROCHE PALO ALTO LLC 2007-02-22 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-20070042988-A1 Antiviral phosphoramidates RPP30, RNASE1, ADORA2B ALDH1A1 1942/4885CYP2C9 614/4885LMNA 3990/4885

“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.