SCHEMBL13629423

SCHEMBL13629423

CCc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1C

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.60
CYP19A1 P11511 1/20 0.58
FFAR4 Q5NUL3 2/20 0.55
ALDH1A1 P00352 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
PKM P14618 3/20 0.52
MAPT P10636 3/20 0.51
ATIC P31939 1/20 0.51
GAA P10253 1/20 0.51
ESR1 P03372 1/20 0.50
HIF1A Q16665 1/20 0.49
FFAR1 O14842 1/20 0.49
PRMT1 Q99873 1/20 0.49

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
SCHEMBL13629553 0.88 PKM (0.56) ALDH1A1PKMMAPT
SCHEMBL13629414 0.88 MAPT (0.55) CYP19A1FFAR4ALDH1A1TDP1PKM
SCHEMBL13852925 0.85 PKM (0.75) ALDH1A1TDP1PKMMAPTHIF1A
SCHEMBL13629403 0.84 CES1 (0.58) CES1CYP19A1FFAR4ALDH1A1TDP1
SCHEMBL13629552 0.83 PKM (0.74) CYP19A1FFAR4ALDH1A1PKMMAPT
SCHEMBL13629421 0.82 BRD4 (0.56) FFAR4MAPTHIF1AFFAR1
SCHEMBL13629329 0.82 ALDH1A1 (0.65) ALDH1A1TDP1MAPT
SCHEMBL7181291 0.81 CES1 (0.62) CES1CYP19A1FFAR4ALDH1A1TDP1
SCHEMBL17174222 0.80 CES1 (0.66) CES1CYP19A1FFAR4ALDH1A1TDP1
SCHEMBL6553107 0.78 UCHL1 (0.76) CES1ALDH1A1TDP1MAPTPRMT1

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 CES1 3173/4885CYP19A1 3220/4885FFAR4 3913/4885

“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.