SCHEMBL1110232

SCHEMBL1110232

CCCCC(C(=O)O)N(c1ccc2ccc(NC(=O)c3ccccc3)cc2c1)S(=O)(=O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.42
CA1 P00915 3/20 0.42
CA9 Q16790 3/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 5/20 0.39
MAPT P10636 4/20 0.39
HTT P42858 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
ESRRG P62508 1/20 0.39
TP53 P04637 1/20 0.39
PPARA Q07869 2/20 0.38
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
ACE2 Q9BYF1 1/20 0.37

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
SCHEMBL1318633 0.88 NPC1 (0.39) CA12CA1CA9MEN1KMT2A
SCHEMBL1319541 0.88 NAMPT (0.45) CA12CA1CA9RAB9A
SCHEMBL1110182 0.82 PSEN1 (0.36) PPARAPPARGPPARD
SCHEMBL1110236 0.82 KDR (0.41) CA12CA1CA9MEN1KMT2A
SCHEMBL1110298 0.81 MMP13 (0.36) CA12CA1CA9ALDH1A1
SCHEMBL1110153 0.81 CA12 (0.46) CA12CA9MAPTALDH1A1TP53
SCHEMBL1110188 0.80 PSEN1 (0.39) LMNASMN1; SMN2ALDH1A1PPARAPPARG
SCHEMBL1110381 0.79 RORC (0.37)
SCHEMBL4233539 0.79 NPC1 (0.47) MEN1KMT2ANPC1RAB9ATDP1
SCHEMBL1110289 0.79 PSEN1 (0.38) MEN1KMT2AMAPTHTTPOLB

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-20110269761-A1 ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-03 US disclosed
EP-2279173-A1 NEW ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-02 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-20110269761-A1 ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS SULT2A1, UGT1A1, SLC5A1 CA12 4672/4885CA1 4638/4885CA9 3498/4885

“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.