SCHEMBL4767922

SCHEMBL4767922

O=C(OCc1ccc(C(F)(F)F)nc1)c1ccc(NS(=O)(=O)CCc2cccc(Cl)c2Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
MAPT P10636 5/20 0.37
RAB9A P51151 2/20 0.37
ALDH1A1 P00352 2/20 0.37
P2RX7 Q99572 7/20 0.36
NPC1 O15118 1/20 0.36
IKBKB O14920 1/20 0.35
MAPK1 P28482 2/20 0.35
NAMPT P43490 1/20 0.35
HPGD P15428 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL4767854 0.85 MAPT (0.46) MAPTALDH1A1NAMPTMEN1KMT2A
SCHEMBL4775262 0.83 MAPT (0.47) MAPTRAB9AALDH1A1NPC1IKBKB
SCHEMBL4768151 0.78 MAPT (0.49) MAPTALDH1A1NAMPTMEN1KMT2A
SCHEMBL4767929 0.78 GAA (0.42) MAPTALDH1A1MEN1KMT2A
SCHEMBL5572196 0.77 PPARA (0.42) MAPTALDH1A1P2RX7NAMPTMEN1
SCHEMBL4776751 0.77 P2RX7 (0.41) MAPTP2RX7NAMPTMEN1KMT2A
SCHEMBL4775016 0.77 DGAT2 (0.46) MAPTNAMPTMEN1KMT2ANPSR1
SCHEMBL4776657 0.76 LMNA (0.41) MAPTP2RX7NAMPTHPGD
SCHEMBL4775223 0.76 DGAT2 (0.47) MAPTP2RX7MEN1KMT2ANPSR1
SCHEMBL4776450 0.75 STAT3 (0.44) MAPTRAB9ANPC1IKBKBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1942888-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-07-16 EP claimed
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US claimed
WO-2007056078-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-18 WO 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 KDM4E 3267/4885MAPT 294/4885RAB9A 1213/4885

“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.