SCHEMBL13629466

SCHEMBL13629466

CCc1ccc(NS(=O)(=O)c2ccc(C#N)cc2Cl)cc1F

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 4/20 0.46
BRD1 O95696 2/20 0.45
BRPF3 Q9ULD4 2/20 0.45
SLC22A12 Q96S37 10/20 0.44
SMARCA2 P51531 1/20 0.41
TRPV4 Q9HBA0 1/20 0.41
PPARG P37231 2/20 0.41
PIK3C3 Q8NEB9 1/20 0.40
CYP3A4 P08684 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
SCHEMBL13629428 0.87 SLC22A12 (0.48) BRPF1BRD1BRPF3SLC22A12SMARCA2
SCHEMBL13629411 0.84 PPARG (0.55) PPARGCYP3A4
SCHEMBL13629290 0.84 BRD4 (0.52) PPARG
SCHEMBL13615237 0.84 SLC22A12 (0.47) BRPF1BRD1BRPF3SLC22A12TRPV4
SCHEMBL13629338 0.80 SLC22A12 (0.53) SLC22A12
SCHEMBL13629408 0.80 CDK1 (0.51) SLC22A12PPARGCYP3A4
SCHEMBL13629296 0.77 ALDH1A1 (0.57)
SCHEMBL94461 0.76 SLC22A12 (0.48) SLC22A12PPARGPIK3C3CYP3A4
SCHEMBL13629312 0.76 ALDH1A1 (0.58) SLC22A12
SCHEMBL13615230 0.75 SLC22A12 (0.48) BRPF1BRD1BRPF3SLC22A12PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275593-A1 3 Substituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors NOVARTIS AG 2009-11-05 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-20090275593-A1 3 Substituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors TIE1, TEK, MATK BRPF1 3189/4885BRD1 1062/4885BRPF3 312/4885

“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.