SCHEMBL862257

SCHEMBL862257

CC(=O)Nc1cccc(S(=O)(=O)NC(=O)c2c(-c3ccc[nH]c3=O)c3cc(Cl)ccc3n2C)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
KAT8 Q9H7Z6 1/20 0.38
HSD17B10 Q99714 1/20 0.37
FLT1 P17948 6/20 0.37
FLT4 P35916 6/20 0.37
KDR P35968 6/20 0.37
MCL1 Q07820 1/20 0.36
PKM P14618 1/20 0.36
EGFR P00533 1/20 0.35
MAPT P10636 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
FBP1 P09467 1/20 0.35
LMNA P02545 1/20 0.35
PTBP1 P26599 1/20 0.35
P2RX1 P51575 1/20 0.35

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
SCHEMBL862422 0.90 ALDH1A1 (0.39) KDM4EALDH1A1CYP1A2HPGDFLT1
SCHEMBL862372 0.88 ALDH1A1 (0.41) KDM4EALDH1A1CYP1A2HPGDFLT1
SCHEMBL10255303 0.84 CYP2C8 (0.39) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL10260725 0.83 KDM4E (0.47) KDM4EALDH1A1CYP1A2HPGDMCL1
SCHEMBL862443 0.80 TDP2 (0.36) KDM4EALDH1A1CYP1A2HPGDSMN1; SMN2
SCHEMBL862476 0.80 PPARG (0.36) KDM4EALDH1A1CYP1A2HPGDFLT1
SCHEMBL862296 0.79 PPARG (0.41) MCL1
SCHEMBL832354 0.78 PPARG (0.38) KDM4EALDH1A1CYP1A2HPGDFLT1
SCHEMBL10257021 0.78 PPARG (0.39) KDM4EALDH1A1CYP1A2HPGDFLT1
SCHEMBL862329 0.78 PPARG (0.40) FLT1FLT4KDRMCL1PKM

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 KDM4E 1061/4885ALDH1A1 1792/4885CYP1A2 305/4885

“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.