SCHEMBL5448485

SCHEMBL5448485

CCN(Cc1ccccc1)S(=O)(=O)c1ccc(CC(=O)O)cc1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 9/20 0.61
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
CNR2 P34972 7/20 0.58
CNR1 P21554 3/20 0.56
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
POLB P06746 1/20 0.55
CXCR3 P49682 1/20 0.54

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
SCHEMBL5452529 0.88 LMNA (0.59) TAS2R14MEN1KMT2AALDH1A1LMNA
SCHEMBL3837668 0.85 CNR2 (0.71) TAS2R14MEN1KMT2ACNR2CNR1
SCHEMBL1279080 0.84 TAS2R14 (0.77) TAS2R14CNR2CNR1CXCR3
SCHEMBL5450808 0.82 ALDH1A1 (0.62) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL4709007 0.82 TAS2R14 (0.65) TAS2R14MEN1KMT2AALDH1A1MAPT
SCHEMBL16568638 0.81 L3MBTL1 (0.64) TAS2R14MEN1KMT2ACNR2CNR1
SCHEMBL6609506 0.80 HTT (0.66) TAS2R14MEN1KMT2ACNR2LMNA
SCHEMBL5466187 0.79 CA9 (0.67) TAS2R14MAPTPOLB
SCHEMBL6607386 0.79 TAS2R14 (0.50) TAS2R14MEN1KMT2AMAPTPOLB
SCHEMBL16058260 0.78 CNR2 (0.58) TAS2R14MEN1KMT2ACNR2CNR1

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
US-20070010526-A1 Therapeutic isoquinoline compounds ASTRAZENECA AB (SE) 2007-01-11 US disclosed
CN-1608061-A Therapeutic isoquinoline compounds ASTRAZENECA AB (SE) 2005-04-20 CN disclosed
EP-1451172-A1 THERAPEUTIC ISOQUINOLINE COMPOUNDS AstraZeneca AB (SE) 2004-09-01 EP disclosed
WO-2003037887-A1 THERAPEUTIC ISOQUINOLINE COMPOUNDS ASTRAZENECA AB (SE) 2003-05-08 WO 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-20070010526-A1 Therapeutic isoquinoline compounds HTR1B, HTR1D, HTR1A TAS2R14 315/4885MEN1 385/4885KMT2A 1271/4885

“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.