SCHEMBL862580

SCHEMBL862580

CS(=O)(=O)Nc1cccc(S(=O)(=O)NC(=O)c2c(-c3ccc[nH]c3=O)c3cc(Cl)ccc3n2Cc2ccccc2CN)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.38
LOXL2 Q9Y4K0 3/20 0.36
PPARG P37231 5/20 0.35
SERPINE1 P05121 3/20 0.34
KMT2A Q03164 2/20 0.33
TDP2 O95551 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
RCE1 Q9Y256 1/20 0.32
FLT1 P17948 4/20 0.32
FLT4 P35916 4/20 0.32
KDR P35968 4/20 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
SCHEMBL862454 0.94 CYP2C8 (0.39) CYP2C8LOXL2PPARGSERPINE1KMT2A
SCHEMBL862574 0.92 CYP2C8 (0.41) CYP2C8LOXL2PPARGSERPINE1KMT2A
SCHEMBL862460 0.92 CYP2C8 (0.41) CYP2C8LOXL2PPARGSERPINE1KMT2A
SCHEMBL862488 0.92 SERPINE1 (0.38) CYP2C8LOXL2PPARGSERPINE1KMT2A
SCHEMBL862329 0.92 PPARG (0.40) CYP2C8LOXL2PPARGSERPINE1KMT2A
SCHEMBL862192 0.91 PPARG (0.39) CYP2C8LOXL2PPARGSERPINE1KMT2A
SCHEMBL862708 0.91 CYP2C8 (0.38) CYP2C8PPARGSERPINE1KMT2ATDP2
SCHEMBL862296 0.90 PPARG (0.41) CYP2C8PPARGSERPINE1KMT2ATDP2
SCHEMBL862590 0.89 CYP2C8 (0.39) CYP2C8LOXL2PPARGSERPINE1KMT2A
SCHEMBL862443 0.89 TDP2 (0.36) CYP2C8LOXL2PPARGKMT2ATDP2

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 2 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-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 CYP2C8 847/4885LOXL2 2406/4885PPARG 4093/4885

“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.