SCHEMBL7103879

SCHEMBL7103879

O=C(Nc1cccc(N(S(=O)(=O)c2cc(Cl)cc(Cl)c2)S(=O)(=O)c2cc(Cl)cc(Cl)c2)c1)Nc1c(Cl)cccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.50
MEN1 O00255 7/20 0.50
KMT2A Q03164 7/20 0.50
LMNA P02545 4/20 0.50
USP2 O75604 1/20 0.50
IDH2 P48735 1/20 0.47
HTT P42858 2/20 0.44
ALDH1A1 P00352 2/20 0.44
CNR1 P21554 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
FBP1 P09467 1/20 0.43
RAB9A P51151 3/20 0.43
IDH1 O75874 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NPC1 O15118 2/20 0.42
TP53 P04637 1/20 0.41

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
SCHEMBL7522388 0.90 MAPT (0.57) MAPTMEN1KMT2ALMNAUSP2
SCHEMBL7518000 0.83 LMNA (0.52) MAPTMEN1KMT2ALMNAHTT
SCHEMBL7514901 0.80 MAPT (0.55) MAPTMEN1KMT2ALMNAUSP2
SCHEMBL7518541 0.74 ALDH1A1 (0.55) MAPTMEN1KMT2ALMNAUSP2
SCHEMBL7103877 0.72 S1PR1 (0.39)
SCHEMBL7103484 0.71 MEN1 (0.52) MAPTMEN1KMT2ALMNAHTT
SCHEMBL7101780 0.71 GAA (0.52) MAPTMEN1KMT2ALMNAHTT
SCHEMBL7803996 0.70 TSHR (0.58) MAPTMEN1KMT2ALMNAHTT
SCHEMBL3419678 0.69 NPSR1 (0.59) MAPTMEN1KMT2ALMNAIDH2
SCHEMBL6836510 0.68 P2RY1 (0.49) MAPTMEN1KMT2ALMNAHTT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1339668-A2 BISUBSTITUTED CARBOCYCLIC CYCLOPHILIN BINDING COMPOUNDS AND THEIRUS GUILFORD PHARMACEUTICALS INC. (US) 2003-09-03 EP claimed
US-20020127605-A1 Bisubstituted carbocyclic cyclophilin binding compounds and their use GUILFORD PHARMACEUTICALS, INC. 2002-09-12 US claimed
WO-2002044126-A2 BISUBSTITUTED CARBOCYCLIC CYCLOPHILIN BINDING COMPOUNDS AND THEIRUS GUILFORD PHARMACEUTICALS INC. (US) 2002-06-06 WO claimed
US-20020127605-A1 Bisubstituted carbocyclic cyclophilin binding compounds and their use GUILFORD PHARMACEUTICALS, INC. 2002-09-12 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-20020127605-A1 Bisubstituted carbocyclic cyclophilin binding compounds and their use PPIG, PIN1, PPIH MAPT 1168/4885MEN1 4855/4885KMT2A 4656/4885

“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.