SCHEMBL832354

SCHEMBL832354

CS(=O)(=O)Nc1cccc(S(=O)(=O)NC(=O)c2c(-c3ccc[nH]c3=O)c3cc(Cl)ccc3n2CCC(F)(F)F)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.38
TDP2 O95551 1/20 0.34
CYP2C8 P10632 1/20 0.33
FLT1 P17948 3/20 0.33
FLT4 P35916 3/20 0.33
KDR P35968 3/20 0.33
P2RX1 P51575 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
HPGD P15428 1/20 0.33
PTGDR2 Q9Y5Y4 2/20 0.33
LOXL2 Q9Y4K0 1/20 0.32
CHEK1 O14757 1/20 0.32
WEE1 P30291 1/20 0.32
MCL1 Q07820 1/20 0.32
SERPINE1 P05121 1/20 0.32
PLK1 P53350 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
SCHEMBL10257021 0.93 PPARG (0.39) PPARGTDP2CYP2C8FLT1FLT4
SCHEMBL862476 0.91 PPARG (0.36) PPARGTDP2CYP2C8FLT1FLT4
SCHEMBL862443 0.90 TDP2 (0.36) PPARGTDP2CYP2C8FLT1FLT4
SCHEMBL862296 0.88 PPARG (0.41) PPARGTDP2CYP2C8PTGDR2MCL1
SCHEMBL862422 0.87 ALDH1A1 (0.39) PPARGTDP2FLT1FLT4KDR
SCHEMBL862329 0.87 PPARG (0.40) PPARGTDP2CYP2C8FLT1FLT4
SCHEMBL862574 0.87 CYP2C8 (0.41) PPARGTDP2CYP2C8ALDH1A1HPGD
SCHEMBL862488 0.86 SERPINE1 (0.38) PPARGTDP2CYP2C8FLT1FLT4
SCHEMBL862454 0.86 CYP2C8 (0.39) PPARGTDP2CYP2C8FLT1FLT4
SCHEMBL862708 0.86 CYP2C8 (0.38) PPARGTDP2CYP2C8FLT1FLT4

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-8143305-B2 2,3-substituted indole derivatives for treating viral infections SCHERING CORPORATION (US) 2012-03-27 US disclosed
US-8143305-B2 2,3-substituted indole derivatives for treating viral infections SCHERING CORPORATION (US) 2012-03-27 US disclosed
US-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS MERCK SHARP & DOHME CORP. 2011-02-10 US disclosed
US-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS MERCK SHARP & DOHME CORP. 2011-02-10 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-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS IDO2, IDO1, IRF3 PPARG 4093/4885TDP2 971/4885CYP2C8 847/4885

“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.