SCHEMBL4169726

SCHEMBL4169726

CCc1onc(C(C)NS(=O)(=O)c2ccc(Cl)cc2)c1CC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 18/20 1.00
KMT2A Q03164 1/20 0.45
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL3889414 0.87 S1PR1 (0.77) S1PR1KMT2ACYP2D6CYP2C19CA1
SCHEMBL3892610 0.84 S1PR1 (0.72) S1PR1KMT2ACYP2D6CYP2C19
SCHEMBL3887084 0.82 S1PR1 (0.69) S1PR1KMT2ACYP2D6CYP2C19
SCHEMBL13875326 0.76 S1PR1 (0.78) S1PR1KMT2ACYP2D6CYP2C19
SCHEMBL4164349 0.76 S1PR1 (1.00) S1PR1KMT2ACYP2D6CYP2C19CA1
SCHEMBL13875330 0.76 S1PR1 (1.00) S1PR1KMT2ACYP2D6CYP2C19CA1
SCHEMBL4164417 0.75 S1PR1 (0.60) S1PR1KMT2A
SCHEMBL4164065 0.75 S1PR1 (0.60) S1PR1KMT2ACA2
SCHEMBL4166561 0.74 S1PR1 (0.59) S1PR1KMT2ACYP2D6CYP2C19
SCHEMBL4161985 0.73 S1PR1 (0.73) S1PR1KMT2ACYP2D6CYP2C19CA1

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-20090111860-A1 SULFONAMIDE COMPOUNDS USEFUL AS ADG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-30 US disclosed
US-20090111860-A1 SULFONAMIDE COMPOUNDS USEFUL AS ADG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-30 US disclosed
US-20090111860-A1 SULFONAMIDE COMPOUNDS USEFUL AS ADG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-30 US disclosed
WO-2007129019-A1 SULFONAMIDE COMPOUNDS USEFUL AS EDG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2007-11-15 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-20090111860-A1 SULFONAMIDE COMPOUNDS USEFUL AS ADG RECEPTOR MODULATORS ADGRE5, ADGRF1, SELPLG S1PR1 677/4885KMT2A 4098/4885CYP2D6 3110/4885

“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.