SCHEMBL831536

SCHEMBL831536

CCc1ccc2c(c1)c(-c1ccc(C)[nH]c1=O)c(C(=O)NS(=O)(=O)c1cccc(N)c1)n2Cc1ccccc1F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.40
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
PARG Q86W56 2/20 0.36
KAT6A Q92794 1/20 0.35
PCK1 P35558 2/20 0.34
ADAM17 P78536 1/20 0.33
ECE1 P42892 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
PTPRC P08575 1/20 0.32
PTPN1 P18031 1/20 0.32
PTPRG P23470 1/20 0.32
POLB P06746 1/20 0.32
AGTR1 P30556 1/20 0.32
AGTR2 P50052 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
SCHEMBL862506 0.87 KMT2A (0.41) PPARGKMT2AMEN1PARGPCK1
SCHEMBL831842 0.85 KMT2A (0.39) KMT2AMEN1PARGPCK1ECE1
SCHEMBL832157 0.84 KMT2A (0.38) KMT2AMEN1PARGPCK1PTGDR2
SCHEMBL829588 0.82 PPARG (0.44) PPARGKMT2AMEN1PARGKAT6A
SCHEMBL12665499 0.82 KMT2A (0.45) KMT2AMEN1PTGDR2
SCHEMBL831414 0.81 PPARG (0.42) PPARGKMT2AMEN1PARGKAT6A
SCHEMBL831747 0.81 PTGER3 (0.38) PPARGKMT2AMEN1PARGPTPRG
SCHEMBL831401 0.79 PTGDR2 (0.38) PPARGPTGDR2
SCHEMBL831757 0.79 PTGDR2 (0.38) PPARGPTGDR2
SCHEMBL862184 0.79 PPARG (0.39) PPARGKMT2AMEN1PARGPCK1

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 4093/4885KMT2A 321/4885MEN1 2084/4885

“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.