SCHEMBL4768048

SCHEMBL4768048

CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc(N(Cc2ccccc2Cl)S(C)(=O)=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.54
NPSR1 Q6W5P4 3/20 0.53
HSP90AA1 P07900 1/20 0.52
ALDH1A1 P00352 6/20 0.50
KMT2A Q03164 3/20 0.50
MAPT P10636 3/20 0.50
MEN1 O00255 2/20 0.50
PTGES O14684 1/20 0.49
ALOX5 P09917 1/20 0.49
GAA P10253 3/20 0.47
TSHR P16473 1/20 0.47
PKM P14618 1/20 0.44
TAS2R14 Q9NYV8 1/20 0.44

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
SCHEMBL4767807 0.84 NPSR1 (0.74) NPSR1HSP90AA1ALDH1A1KMT2AMAPT
SCHEMBL4768044 0.79 HPGD (0.52) HPGDHSP90AA1ALDH1A1KMT2AMEN1
SCHEMBL10107755 0.75 HSP90AA1 (0.66) HPGDHSP90AA1ALDH1A1KMT2AMEN1
SCHEMBL4791474 0.75 ALDH1A1 (0.61) HPGDNPSR1HSP90AA1ALDH1A1KMT2A
SCHEMBL95064 0.74 HPGD (0.65) HPGDNPSR1HSP90AA1ALDH1A1KMT2A
SCHEMBL14497659 0.74 GAA (0.59) HPGDNPSR1ALDH1A1KMT2AMAPT
SCHEMBL4775048 0.73 GAA (0.70) HPGDNPSR1ALDH1A1MAPTGAA
SCHEMBL4777536 0.73 GAA (0.58) HPGDNPSR1ALDH1A1KMT2AMAPT
SCHEMBL4768069 0.71 GAA (0.64) HPGDNPSR1ALDH1A1KMT2AMAPT
SCHEMBL4774743 0.71 ALDH1A1 (0.60) HPGDNPSR1ALDH1A1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US claimed
EP-1942888-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-07-16 EP disclosed
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US disclosed
WO-2007056078-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-18 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-20070135435-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 HPGD 2681/4885NPSR1 4395/4885HSP90AA1 726/4885

“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.