SCHEMBL310996

SCHEMBL310996

CC(=O)OCc1ccn(S(=O)(=O)c2ccc(C)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
ALDH1A1 P00352 4/20 0.44
GRM4 Q14833 1/20 0.43
PKM P14618 1/20 0.43
HTR6 P50406 1/20 0.42
LMNA P02545 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40
TSHR P16473 1/20 0.40
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL27572536 0.80 CA1 (0.45) CA1CA2ALDH1A1GRM4PKM
SCHEMBL4521506 0.80 CA1 (0.54) CA1CA2ALDH1A1GRM4PKM
SCHEMBL7775878 0.79 CA1 (0.50) CA1CA2ALDH1A1GRM4PKM
SCHEMBL7781061 0.78 CA1 (0.46) CA1CA2ALDH1A1GRM4PKM
SCHEMBL18920634 0.78 ALDH1A1 (0.47) CA1CA2ALDH1A1GRM4HTR6
SCHEMBL28748262 0.78 CA1 (0.43) CA1CA2ALDH1A1GRM4PKM
SCHEMBL4227579 0.77 HTR6 (0.52) CA1CA2ALDH1A1GRM4PKM
SCHEMBL21806794 0.77 CA1 (0.54) CA1CA2ALDH1A1GRM4PKM
SCHEMBL18920680 0.77 HTR6 (0.52) CA1CA2ALDH1A1GRM4PKM
SCHEMBL10050491 0.76 CA1 (0.44) CA1CA2ALDH1A1GRM4PKM

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
US-8092661-B2 Electropolymerisable monomers, soluble in an aqueous solution and comprising a metalloporphyrin BIOMERIEUX (FR) 2012-01-10 US disclosed
US-20090314660-A1 Novel Electropolymerisable Monomers, Soluble in an Aqueous Solution and Comprising a Metalloporphyrin BIOMERIEUX (FR) 2009-12-24 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-20090314660-A1 Novel Electropolymerisable Monomers, Soluble in an Aqueous Solution and Comprising a Metalloporphyrin EPS15, PPOX, ACR CA1 935/4885CA2 1270/4885ALDH1A1 906/4885

“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.