SCHEMBL3035345

SCHEMBL3035345

Cc1ccc(COS(C)(=O)=O)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.42
THRB P10828 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TP53 P04637 1/20 0.36
ADRA1D P25100 2/20 0.34
RIPK1 Q13546 1/20 0.34
KDM4C Q9H3R0 1/20 0.33
PTGS2 P35354 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
MMP9 P14780 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL17595984 0.88 KDM4E (0.37) KDM4EALDH1A1USP2LMNAMMP9
SCHEMBL9901169 0.81 DPP4 (0.41) KDM4EALDH1A1PTGS2USP2LMNA
SCHEMBL16544564 0.78 STAT3 (0.39) PRMT6KMT2AALDH1A1MEN1GAA
SCHEMBL15270985 0.77 MAPK1 (0.33) KMT2A
SCHEMBL16472595 0.77
SCHEMBL4122345 0.75 NR1D1 (0.36)
SCHEMBL960878 0.74 MAPT (0.46) KMT2AKDM4EALDH1A1MEN1GAA
SCHEMBL12461696 0.73
SCHEMBL19051432 0.71 PRMT6 (0.44) PRMT6THRBKMT2AKDM4EALDH1A1
SCHEMBL4570607 0.71 PRMT6 (0.44) PRMT6THRBKMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100216813-A1 PYRROLIDINEANILINES SMITHKLINE BEECHAM CORPORATION 2010-08-26 US disclosed
EP-1954133-A2 PYRROLIDINEANILINES SMITHKLINE BEECHAM CORPORATION (US) 2008-08-13 EP disclosed
WO-2007065093-A2 PYRROLIDINEANILINES SMITHKLINE BEECHAM CORPORATION (US) 2007-06-07 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-20100216813-A1 PYRROLIDINEANILINES PGF, ARG1, CYP19A1 PRMT6 151/4885THRB 4646/4885KMT2A 194/4885

“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.