SCHEMBL862215

SCHEMBL862215

CS(=O)(=O)NC(=O)c1c(-c2ccc[nH]c2=O)c2cc(OC(F)(F)F)ccc2n1Cc1ccccc1F

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.43
CYP2C8 P10632 1/20 0.42
KMT2A Q03164 3/20 0.41
SERPINE1 P05121 1/20 0.39
SCN9A Q15858 2/20 0.38
ABL1 P00519 1/20 0.38
SCN5A Q14524 1/20 0.38
MEN1 O00255 1/20 0.38
F2RL3 Q96RI0 7/20 0.38
CYP2C9 P11712 3/20 0.37
CYP2D6 P10635 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
TRPV1 Q8NER1 1/20 0.36

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
SCHEMBL862206 0.93 CYP2C8 (0.43) PPARGCYP2C8KMT2ASERPINE1SCN9A
SCHEMBL862333 0.92 F2RL3 (0.45) PPARGCYP2C8SERPINE1SCN9AABL1
SCHEMBL10257585 0.92 PPARG (0.40) PPARGCYP2C8SERPINE1SCN9AABL1
SCHEMBL10261596 0.92 PPARG (0.46) PPARGCYP2C8KMT2AMEN1
SCHEMBL862397 0.91 TP53 (0.44) PPARGCYP2C8KMT2ASCN9ASCN5A
SCHEMBL831415 0.89 PPARG (0.46) PPARGCYP2C8KMT2ASCN9ASCN5A
SCHEMBL862351 0.88 CYP2C8 (0.43) PPARGCYP2C8KMT2ASCN9ASCN5A
SCHEMBL831577 0.88 CYP2C8 (0.46) PPARGCYP2C8KMT2ASCN9ASCN5A
SCHEMBL12673703 0.88 CYP2C8 (0.51) CYP2C8KMT2ASERPINE1ABL1MEN1
SCHEMBL831693 0.87 CYP2C8 (0.42) PPARGCYP2C8KMT2ASERPINE1MEN1

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 PPARG 4093/4885CYP2C8 847/4885KMT2A 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.