SCHEMBL4417162

SCHEMBL4417162

COc1cc2c(c(OC)c1)C(c1cccc(OC(F)(F)F)c1)N(S(=O)(=O)c1cccs1)CC2

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
PKM P14618 2/20 0.43
ALDH1A1 P00352 2/20 0.43
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
FKBP1A P62942 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
CA9 Q16790 3/20 0.37
CA14 Q9ULX7 3/20 0.37
TAS2R14 Q9NYV8 1/20 0.37
MAPK1 P28482 1/20 0.37
POLB P06746 1/20 0.37
HCRTR1 O43613 1/20 0.36

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
SCHEMBL4552332 0.86 TAS2R14 (0.49) PKMALDH1A1NPSR1L3MBTL1FKBP1A
SCHEMBL13972857 0.86 TAS2R14 (0.49) PKMALDH1A1NPSR1L3MBTL1FKBP1A
SCHEMBL4422262 0.85 NPSR1 (0.40) NPSR1L3MBTL1FKBP1ACA1CA2
SCHEMBL6030159 0.85 NPSR1 (0.41) SMN1; SMN2NPSR1L3MBTL1FKBP1ATP53
SCHEMBL4410698 0.84 NPSR1 (0.41) NPSR1L3MBTL1FKBP1AMAPTCA1
SCHEMBL4423028 0.82 CA1 (0.41) ALDH1A1NPSR1L3MBTL1TP53MAPT
SCHEMBL13973317 0.82 CA1 (0.41) ALDH1A1NPSR1L3MBTL1TP53MAPT
SCHEMBL4414908 0.82 PKM (0.48) SMN1; SMN2PKMALDH1A1FKBP1ACA1
SCHEMBL4415190 0.82 CA1 (0.41) NPSR1L3MBTL1FKBP1ACA1CA2
SCHEMBL4422266 0.81 HTR6 (0.40) NPSR1L3MBTL1FKBP1ACA1CA2

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-1663983-B1 N-SUBSTITUTED, 6,8-DIALKOXY-1,2,3,4-TETRAHYDRO-1H-ISOQUINOLINE AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2009-01-21 EP disclosed
US-20050070570-A1 Novel potassium channels modulators 4SC AG (DE) 2005-03-31 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-20050070570-A1 Novel potassium channels modulators HCN4, KCNA4, KCNN4 SMN1; SMN2 4121/4885PKM 1619/4885ALDH1A1 3171/4885

“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.