SCHEMBL5283947

SCHEMBL5283947

COC(=O)CNc1ccccc1S(C)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 3/20 0.47
ADRA2A P08913 1/20 0.44
ADRA2C P18825 1/20 0.44
ADRA1D P25100 1/20 0.44
ADRA1B P35368 1/20 0.44
THRB P10828 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CA1 P00915 5/20 0.40
CA2 P00918 5/20 0.40
BCAT2 O15382 1/20 0.40
CA9 Q16790 4/20 0.39
CA12 O43570 3/20 0.39
CA14 Q9ULX7 2/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
NPC1 O15118 2/20 0.39
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL9023668 0.86 CA1 (0.56) CA1CA2CA9CA12CA14
SCHEMBL697565 0.83 ADRA1A (0.49) ADRA1AADRA2AADRA2CADRA1DADRA1B
SCHEMBL5286168 0.83 HTR6 (0.55) CA1CA2CA9CA12CA14
SCHEMBL5281876 0.83 ADRA1A (0.41) ADRA1AADRA2AADRA2CADRA1DADRA1B
SCHEMBL5568656 0.80 HTR6 (0.44) TDP1ALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL9779960 0.76 MAPT (0.53) THRBTDP1ALDH1A1KDM4ENPC1
SCHEMBL29926763 0.76 MAPT (0.45) THRBTDP1CA1CA2CA9
SCHEMBL6902818 0.76 MAPT (0.45) THRBTDP1CA1CA2CA9
SCHEMBL6609387 0.76 KMT2A (0.56) ALDH1A1MEN1KMT2APOLB
SCHEMBL13589493 0.75 ADRA1A (0.48) ADRA1AADRA2AADRA2CADRA1DADRA1B

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
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO disclosed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 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-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 ADRA1A 2533/4885ADRA2A 2296/4885ADRA2C 2674/4885

“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.