SCHEMBL8545161

SCHEMBL8545161

CCOC(=O)c1[nH]c2cc(F)ccc2c1N

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.64
ALDH1A1 P00352 5/20 0.64
MAPT P10636 5/20 0.64
GAA P10253 4/20 0.64
SMN1; SMN2 Q16637 4/20 0.64
NPC1 O15118 2/20 0.64
RAB9A P51151 2/20 0.64
TP53 P04637 1/20 0.64
HPGD P15428 5/20 0.62
NPSR1 Q6W5P4 3/20 0.62
ALOX15 P16050 7/20 0.53
USP2 O75604 1/20 0.51
HSD17B10 Q99714 1/20 0.51
KMT2A Q03164 6/20 0.48
CCR3 P51677 1/20 0.48
MEN1 O00255 3/20 0.47
MAPK1 P28482 2/20 0.47
TSHR P16473 1/20 0.47
LMNA P02545 1/20 0.47
DRD2 P14416 1/20 0.46

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
SCHEMBL31682820 0.89 ALDH1A1 (0.76) KDM4EALDH1A1MAPTGAASMN1; SMN2
SCHEMBL14174305 0.89 ALDH1A1 (0.76) KDM4EALDH1A1MAPTGAASMN1; SMN2
SCHEMBL14174311 0.84 ALOX15 (0.70) KDM4EALDH1A1MAPTGAASMN1; SMN2
SCHEMBL28477589 0.84 KDM4E (0.64) KDM4EALDH1A1MAPTGAASMN1; SMN2
SCHEMBL8540507 0.83 KDM4E (0.60) KDM4EALDH1A1MAPTGAASMN1; SMN2
SCHEMBL14534526 0.82 KDM4E (0.61) KDM4EALDH1A1MAPTGAASMN1; SMN2
SCHEMBL29954264 0.82 ALOX15 (0.73) KDM4EALDH1A1MAPTGAASMN1; SMN2
SCHEMBL8050330 0.81 KDM4E (0.51) KDM4EALDH1A1MAPTGAASMN1; SMN2
SCHEMBL14174308 0.81 ALDH1A1 (0.60) KDM4EALDH1A1MAPTGAASMN1; SMN2
SCHEMBL4332747 0.80 KDM4E (0.70) KDM4EALDH1A1MAPTGAASMN1; SMN2

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501797-B1 3-(SUBSTITUTED AMINO)-1H-INDOLE-2-CARBOXYLIC ACID ESTER AND 3-(SUBSTITUTED AMINO)-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID ESTER DERIVATIVES AS INTERLEUKIN-4 GENE EXPRESSION INHIBITORS AVENTIS PHARMA INC (US) 2009-08-05 EP disclosed
US-20080132481-A1 INTERLEUKIN-4 GENE EXPRESSION INHIBITORS AVENTIS PHARMACEUTICALS INC. 2008-06-05 US disclosed
EP-1834947-A2 3-substituted amino-1H-indole-2-carboxylic acid and 3-substituted amino-benzo[B]thiophene-2carboxylic acid derivatives as interleukin-4 gene expression inhibitors Aventis Pharmaceuticals, Inc. (US) 2007-09-19 EP disclosed
EP-1501796-B1 3-(PYRIDINYL-AMINO)-1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES AS INTERLEUKIN-4 GENE EXPRESSION INHIBITORS AVENTIS PHARMA INC (US) 2007-05-09 EP disclosed
US-7169925-B2 Indole derivatives as interleukin-4 gene expression inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2007-01-30 US disclosed
US-7169925-B2 Indole derivatives as interleukin-4 gene expression inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2007-01-30 US disclosed
EP-0483881-B1 3-Amidoindolyl derivatives MERRELL PHARMA INC (US) 1998-01-21 EP disclosed
US-5703107-A CENTRAL NERVOUS SYSTEM DISORDERS; ANALGESICS; ANTIEPILEPTIC AGENTS MERRELL PHARMACEUTICALS INC. (US) 1997-12-30 US disclosed
US-5675018-A 3-amidoindolyl derivatives MERRELL PHARMACEUTICALS INC. (US) 1997-10-07 US disclosed
US-5491153-A 3-amidoindolyl derivative MERRELL DOW PHARMACEUTICALS INC. (US) 1996-02-13 US disclosed
US-5189054-A 3-amidoindolyl derivatives and pharmaceutical compositions thereof MERRELL DOW PHARMACEUTICALS INC. (US) 1993-02-23 US disclosed
EP-0483881-A1 3-Amidoindolyl derivatives MERRELL PHARMACEUTICALS INC. (US) 1992-05-06 EP 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-20080132481-A1 INTERLEUKIN-4 GENE EXPRESSION INHIBITORS IL4, STAT4, STAT6 KDM4E 93/4885ALDH1A1 1900/4885MAPT 3138/4885

“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.