SCHEMBL1285015

SCHEMBL1285015

CCOC(=O)c1cc2ccc(Cl)cc2nc1C

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.59
ALDH1A1 P00352 6/20 0.58
KDM4E B2RXH2 5/20 0.58
HPGD P15428 3/20 0.58
HSD17B10 Q99714 2/20 0.52
ALOX15 P16050 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
HSP90AA1 P07900 1/20 0.50
MAPT P10636 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL6824035 0.89 TSHR (0.71) TSHRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL16048296 0.84 TSHR (0.60) TSHRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL24951457 0.83 TSHR (0.80) TSHRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL21177057 0.83 TSHR (0.59) TSHRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL29077011 0.83 KDM4E (0.60) TSHRALDH1A1KDM4EHPGDALOX15
SCHEMBL1574317 0.82 KDM4E (0.80) TSHRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1034564 0.81 TSHR (0.68) TSHRALDH1A1KDM4EHPGDALOX15
SCHEMBL16047643 0.81 MAOB (0.66) ALDH1A1KDM4EHPGDKMT2AMEN1
SCHEMBL1284870 0.80 ALDH1A1 (0.71) TSHRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6824675 0.80 KDM4E (0.54) KDM4EALOX15KMT2AMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME PFIZER INC. (US) 2012-04-12 US disclosed
EP-2024272-A2 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME Renovis, Inc. (US) 2009-02-18 EP disclosed
WO-2007133637-A2 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME RENOVIS, INC. (US) 2007-11-22 WO 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-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME TRPV1, TRPA1, TRPV2 TSHR 2959/4885ALDH1A1 1265/4885KDM4E 4075/4885

“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.