SCHEMBL4717293

SCHEMBL4717293

CCCCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)O)c1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.61
TSHR P16473 3/20 0.61
VCAM1 P19320 2/20 0.56
LMNA P02545 3/20 0.55
GAA P10253 2/20 0.52
KDM4E B2RXH2 2/20 0.52
MAPT P10636 3/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
TP53 P04637 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49

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
SCHEMBL7335509 0.90 ALDH1A1 (0.72) ALDH1A1TSHRVCAM1LMNAGAA
SCHEMBL11819840 0.90 VCAM1 (0.62) ALDH1A1TSHRVCAM1LMNAGAA
SCHEMBL11818879 0.90 VCAM1 (0.62) ALDH1A1TSHRVCAM1LMNAGAA
SCHEMBL11826011 0.90 VCAM1 (0.62) ALDH1A1TSHRVCAM1LMNAGAA
SCHEMBL11822366 0.90 VCAM1 (0.62) ALDH1A1TSHRVCAM1LMNAGAA
SCHEMBL11169188 0.84 ALDH1A1 (0.55) ALDH1A1TSHRLMNAGAAKDM4E
SCHEMBL11203128 0.83 ALDH1A1 (0.60) ALDH1A1TSHRLMNAGAAKDM4E
SCHEMBL4715259 0.80 ALDH1A1 (0.56) ALDH1A1TSHRVCAM1LMNAGAA
SCHEMBL11175627 0.78 SMN1; SMN2 (0.51) ALDH1A1VCAM1LMNAKDM4EMAPT
SCHEMBL11177193 0.78 VCAM1 (0.49) ALDH1A1TSHRVCAM1LMNAMAPT

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
EP-1615904-B1 SUBSTITUTED BENZOSULPHONAMIDES AS POTENTIATORS OF GLUTAMATE RECEPTORS ASTRAZENECA AB (SE) 2008-02-27 EP disclosed
US-20070021606-A1 Therapeutic compounds ASTRAZENECA AB (SE) 2007-01-25 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-20070021606-A1 Therapeutic compounds GRIN1, GRIN3A, GRM2 ALDH1A1 1721/4885TSHR 685/4885VCAM1 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.