SCHEMBL2642083

SCHEMBL2642083

CS(=O)(=O)c1cccc(F)c1[O]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.39
ADRA2C P18825 1/20 0.39
ADRA1D P25100 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39
ACLY P53396 1/20 0.36
CCR2 P41597 2/20 0.36
PKM P14618 1/20 0.35
PKLR P30613 1/20 0.35
ALDH1A1 P00352 2/20 0.34
HTT P42858 1/20 0.34
PTGES2 Q9H7Z7 1/20 0.34
PTGS2 P35354 1/20 0.34
AKR1B1 P15121 1/20 0.33
PSIP1 O75475 1/20 0.33
HSD11B1 P28845 1/20 0.33
BCAT2 O15382 1/20 0.33
CNR2 P34972 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 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
SCHEMBL775432 0.80 PTGES2 (0.46) ADRA2AADRA2CADRA1DADRA1AADRA1B
SCHEMBL514170 0.79 ALDH1A1 (0.44) ACLYALDH1A1AKR1B1PSIP1HSD11B1
SCHEMBL13211321 0.78 SLC40A1 (0.44) ADRA2AADRA2CADRA1DADRA1AADRA1B
SCHEMBL6129256 0.77 ADRA2A (0.38) ADRA2AADRA2CADRA1DADRA1AADRA1B
SCHEMBL2642086 0.77 ALB (0.44) ADRA2AADRA2CADRA1DADRA1AADRA1B
SCHEMBL2061390 0.77 ADRA2A (0.38) ADRA2AADRA2CADRA1DADRA1AADRA1B
SCHEMBL16896856 0.75 PTGS2 (0.39) ADRA2AADRA2CADRA1DADRA1AADRA1B
SCHEMBL2642804 0.74 HSD11B1 (0.44) CCR2ALDH1A1HSD11B1
SCHEMBL24603708 0.74 CNR2 (0.37) ADRA2AADRA2CADRA1DADRA1AADRA1B
SCHEMBL2642430 0.74 SLC6A2 (0.35) ADRA2AADRA2CADRA1DADRA1AADRA1B

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
US-7687502-B2 Substituted quinazoline or pyridopyrimidine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-03-30 US disclosed
US-20080032996-A1 Substituted Quinazoline or Pyridopyrimidine Derivative MSD K.K. (JP) 2008-02-07 US disclosed
EP-1734040-A1 SUBSTITUTED QUINAZOLINE OR PYRIDOPYRIMIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-12-20 EP 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-20080032996-A1 Substituted Quinazoline or Pyridopyrimidine Derivative GCK, GCKR, PDXK ADRA2A 1497/4885ADRA2C 1314/4885ADRA1D 1527/4885

“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.