SCHEMBL862883

SCHEMBL862883

O=C(NS(=O)(=O)c1ccc(O)cc1)c1c(-c2ccc[nH]c2=O)c2cc(C3CC3)ccc2n1Cc1ccc(F)cc1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 2/20 0.36
PPARG P37231 2/20 0.35
PTGDR2 Q9Y5Y4 7/20 0.33
FABP4 P15090 1/20 0.31
BCL2L1 Q07817 1/20 0.31
BAK1 Q16611 1/20 0.31
KMT2A Q03164 2/20 0.31
PTGDR Q13258 2/20 0.31
TBXA2R P21731 1/20 0.31
CFB P00751 1/20 0.31
EGLN2 Q96KS0 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
EGLN3 Q9H6Z9 1/20 0.30
BRD4 O60885 1/20 0.30
PER2 O15055 1/20 0.30
CRY1 Q16526 1/20 0.30
CRY2 Q49AN0 1/20 0.30
CHEK1 O14757 1/20 0.30
WEE1 P30291 1/20 0.30
MEN1 O00255 1/20 0.30

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
SCHEMBL862399 0.89 CYP2C8 (0.39) CYP2C8PPARGPTGDR2FABP4KMT2A
SCHEMBL10255439 0.87 CYP2C8 (0.35) CYP2C8PPARGPTGDR2BRD4PER2
SCHEMBL862263 0.86 CYP2C8 (0.38) CYP2C8PPARGPTGDR2KMT2APTGDR
SCHEMBL832610 0.81 PPARG (0.45) CYP2C8PPARGPTGDR2
SCHEMBL831802 0.81 PPARG (0.47) CYP2C8PPARGPTGDR2
SCHEMBL10257342 0.80 SERPINE1 (0.43) CYP2C8PPARGPTGDR2CYP1A2CYP3A4
SCHEMBL862485 0.80 PPARG (0.49) CYP2C8PPARGCYP1A2CYP3A4CYP2D6
SCHEMBL831770 0.80 PPARG (0.46) CYP2C8PPARGPTGDR2
SCHEMBL862166 0.79 CYP2C8 (0.42) CYP2C8PPARGPTGDR2KMT2A
SCHEMBL862560 0.79 FLT1 (0.42) CYP2C8PPARGPTGDR2KMT2AMEN1

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 847/4885PPARG 4093/4885PTGDR2 1609/4885

“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.