SCHEMBL4425654

SCHEMBL4425654

COc1cc2c(c(OC)c1)C(c1ccco1)N(S(=O)(=O)c1ccc(O)c(C(=O)O)c1)CC2

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 2/20 0.43
MMP1 P03956 5/20 0.41
MMP9 P14780 5/20 0.41
MMP2 P08253 4/20 0.41
MMP12 P39900 4/20 0.41
MMP14 P50281 4/20 0.41
MMP15 P51511 4/20 0.41
MMP16 P51512 4/20 0.41
MMP26 Q9NRE1 4/20 0.41
MMP7 P09237 4/20 0.41
FKBP1A P62942 4/20 0.40
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MTNR1B P49286 1/20 0.39
APEX1 P27695 1/20 0.38
GRIN2C Q14957 1/20 0.38
MMP3 P08254 1/20 0.37
MMP13 P45452 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
SCHEMBL4413279 0.83 TAS2R14 (0.45) TAS2R14MMP1MMP9MMP2MMP12
SCHEMBL13973166 0.83 TAS2R14 (0.45) TAS2R14MMP1MMP9MMP2MMP12
SCHEMBL4424185 0.81 LMNA (0.42) MMP9MMP2
SCHEMBL4421998 0.81 CA1 (0.46) FKBP1APOLBTDP1L3MBTL1
SCHEMBL6507930 0.80 NPSR1 (0.43) TAS2R14MMP1MMP9MMP2MMP12
SCHEMBL4416979 0.80 TAS2R14 (0.46) TAS2R14MMP1MMP9MMP2MMP12
SCHEMBL4418766 0.79 MTNR1B (0.51) FKBP1APOLBTDP1L3MBTL1MTNR1B
SCHEMBL4414378 0.79 PKM (0.41) TAS2R14FKBP1AMTNR1BGRIN2C
SCHEMBL4411990 0.77 ALDH1A1 (0.47) FKBP1A
SCHEMBL4413290 0.76 ALDH1A1 (0.41) FKBP1APOLBGRIN2C

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 TAS2R14 514/4885MMP1 4692/4885MMP9 4243/4885

“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.