SCHEMBL2420165

SCHEMBL2420165

COC(=O)c1ccc(S(=O)(=O)O)o1.[NaH]

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.70
HTT P42858 4/20 0.70
TSHR P16473 2/20 0.59
MEN1 O00255 2/20 0.49
CYP1A2 P05177 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP2C19 P33261 1/20 0.49
KDM4E B2RXH2 3/20 0.48
POLB P06746 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALOX12 P18054 1/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SETD7 Q8WTS6 1/20 0.43
GAA P10253 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
MAPT P10636 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL15851421 0.98 ALDH1A1 (0.72) ALDH1A1HTTTSHRMEN1CYP1A2
SCHEMBL30511183 0.85 ALDH1A1 (0.74) ALDH1A1HTTTSHRMEN1CYP1A2
SCHEMBL568296 0.84 ALDH1A1 (0.72) ALDH1A1HTTTSHRMEN1CYP1A2
SCHEMBL2008225 0.82 ALDH1A1 (1.00) ALDH1A1HTTTSHRMEN1CYP1A2
SCHEMBL490373 0.82 ALDH1A1 (0.70) ALDH1A1HTTTSHRMEN1CYP1A2
SCHEMBL8471904 0.81 POLB (0.48) ALDH1A1HTTTSHRMEN1CYP1A2
SCHEMBL24462105 0.81 HTT (0.68) ALDH1A1HTTTSHRMEN1CYP1A2
SCHEMBL2420163 0.81 ALDH1A1 (0.68) ALDH1A1HTTTSHRMEN1CYP1A2
SCHEMBL24462026 0.81 ALDH1A1 (0.68) ALDH1A1HTTTSHRMEN1CYP1A2
SCHEMBL15880660 0.81 ALDH1A1 (0.68) ALDH1A1HTTTSHRMEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1951663-B1 (R)-ARYLKYLAMINO DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DOMPÉ FARMACEUTICI S P A (IT) 2016-07-20 EP disclosed
US-8026367-B2 (R)-arylalkylamino derivatives and pharmaceutical compositions containing them DOMPE PHA.R.MA S.P.A. (IT) 2011-09-27 US disclosed
US-20090124664-A1 (R)-Arylalkylamino Derivatives and Pharmaceutical Compositions Containing Them DOMPÉ FARMACEUTICI S.P.A. (IT) 2009-05-14 US disclosed
EP-1951663-A2 (R)-ARYLKYLAMINO DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DOMPE' pha.r.ma s.p.a. (IT) 2008-08-06 EP disclosed
WO-2007060215-A2 (R)-ARYLKYLAMINO DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DOMPE' PHA.R.MA S.P.A. (IT) 2007-05-31 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-20090124664-A1 (R)-Arylalkylamino Derivatives and Pharmaceutical Compositions Containing Them C3AR1, C5AR1, CCR8 ALDH1A1 907/4885HTT 4761/4885TSHR 2560/4885

“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.