SCHEMBL7608207

SCHEMBL7608207

CN(C)/C=N/S(=O)(=O)c1cccc(-c2ccc(CBr)cc2)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
HSD17B1 P14061 4/20 0.36
HSD17B2 P37059 4/20 0.36
TAAR1 Q96RJ0 1/20 0.34
BCAT1 P54687 1/20 0.34
NR1H3 Q13133 3/20 0.34
NMT1 P30419 2/20 0.34
NR1H2 P55055 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
TNF P01375 1/20 0.33
NOD1 Q9Y239 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 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
SCHEMBL7608214 1.00 LMNA (0.44) LMNAGAAHSD17B1HSD17B2TAAR1
SCHEMBL7613335 0.84 LMNA (0.65) LMNAGAAHSD17B1HSD17B2BCAT1
SCHEMBL7613330 0.84 LMNA (0.65) LMNAGAAHSD17B1HSD17B2BCAT1
SCHEMBL5893176 0.76 NR1H2 (0.51) NR1H3NR1H2
SCHEMBL7567012 0.75 LMNA (0.39) LMNAGAABCAT1
SCHEMBL7567015 0.75 LMNA (0.39) LMNAGAABCAT1
SCHEMBL654704 0.75 LMNA (0.39) LMNAGAABCAT1
SCHEMBL3528429 0.75 LMNA (0.54) LMNAGAAHSD17B2BCAT1NPC1
SCHEMBL3528433 0.75 LMNA (0.54) LMNAGAAHSD17B2BCAT1NPC1
SCHEMBL8264035 0.74 LMNA (0.67) LMNAGAABCAT1ALDH1A1CA12

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-6486189-B2 TREATMENT OR PROPHYLAXIS OF AN ILLNESS CAUSED BY AN ISCHEMIC CONDITION, OR FOR THE TREATMENT OF IMPAIRED RESPIRATORY DRIVE HOECHST AKTIENGESELLSCHAFT (DE) 2002-11-26 US disclosed
US-20020045761-A1 Five-membered heterocycles having biphenylsulfonyl substitution, process for their preparation, their use as a medicament or diagnostic, and medicament comprising them KLEEMANN HEINZ-WERNER (DE) 2002-04-18 US disclosed
US-6335451-B1 ANTIARRYTHMIA AGENTS, ANTIPROLIFERATIVE AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 2002-01-01 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-20020045761-A1 Five-membered heterocycles having biphenylsulfonyl substitution, process for their preparation, their use as a medicament or diagnostic, and medicament comprising them BAX, BCL2, TNNI3 LMNA 230/4885GAA 2799/4885HSD17B1 1942/4885

“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.