SCHEMBL862473

SCHEMBL862473

CC(C)(C)S(=O)(=O)NC(=O)c1c(-c2ccc[nH]c2=O)c2cc(Cl)ccc2n1Cc1cc(F)ccc1F

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.43
PTGDR2 Q9Y5Y4 7/20 0.36
KMT2A Q03164 5/20 0.35
MAPT P10636 3/20 0.35
HPGD P15428 3/20 0.34
KDM4E B2RXH2 2/20 0.34
CYP1A2 P05177 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL831268 0.91 CYP2C8 (0.45) CYP2C8PTGDR2KMT2AMAPTHPGD
SCHEMBL861967 0.91 CYP2C8 (0.44) CYP2C8PTGDR2KMT2AMAPTHPGD
SCHEMBL862472 0.88 CYP2C8 (0.43) CYP2C8PTGDR2KMT2AMAPTHPGD
SCHEMBL862560 0.88 FLT1 (0.42) CYP2C8PTGDR2KMT2AHPGDMEN1
SCHEMBL862166 0.88 CYP2C8 (0.42) CYP2C8PTGDR2KMT2AHPGD
SCHEMBL862266 0.88 CYP2C8 (0.48) CYP2C8PTGDR2KMT2AMAPTHPGD
SCHEMBL862717 0.88 CYP2C8 (0.42) CYP2C8PTGDR2KMT2AMEN1
SCHEMBL832498 0.88 CYP2C8 (0.45) CYP2C8PTGDR2KMT2AMAPTHPGD
SCHEMBL862164 0.88 CYP2C8 (0.42) CYP2C8PTGDR2KMT2AMAPTHPGD
SCHEMBL832199 0.87 CYP2C8 (0.46) CYP2C8PTGDR2KMT2AMAPTHPGD

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 847/4885PTGDR2 1609/4885KMT2A 321/4885

“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.