SCHEMBL5751187

SCHEMBL5751187

O=C(O)N1C(=O)OC(c2ccc(F)cc2)C1Cc1cnc(C(F)(F)F)s1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
EGLN3 Q9H6Z9 1/20 0.35
MAOB P27338 1/20 0.34
CACNA1G O43497 3/20 0.33
CACNA1H O95180 3/20 0.33
CACNA1I Q9P0X4 3/20 0.33
KCNN4 O15554 1/20 0.33
MEN1 O00255 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
RECQL P46063 1/20 0.31
ENPP2 Q13822 3/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
MTOR P42345 1/20 0.30

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
SCHEMBL5751613 0.78 KCNN4 (0.39) MAOBKCNN4ALDH1A1
SCHEMBL5752015 0.76 KCNN4 (0.34) MAOBCACNA1GCACNA1HCACNA1IKCNN4
SCHEMBL5754544 0.73 GRM5 (0.38)
SCHEMBL5754320 0.71 UBE2M (0.35) MAOBKCNN4MAPTFADS1
SCHEMBL5752464 0.71 KCNN4 (0.33) MAOBKCNN4
SCHEMBL5752580 0.70 FADS1 (0.44) MAPTFADS1
SCHEMBL5755612 0.70 KCNN4 (0.35) MAOBKCNN4ALDH1A1FADS1
SCHEMBL5752417 0.70 KCNN4 (0.33) MAOBKCNN4
SCHEMBL5752174 0.69 CES2 (0.37)
SCHEMBL7118804 0.69 CYP3A4 (0.39) ALDH1A1

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-6982348-B2 Aminoethanol derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-03 US disclosed
US-20040127574-A1 Aminoethanol derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-07-01 US disclosed
EP-1362846-A1 AMINOETHANOL DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2003-11-19 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-20040127574-A1 Aminoethanol derivatives CETP, LCAT, MTTP EGLN2 1015/4885EGLN1 869/4885EGLN3 1289/4885

“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.