SCHEMBL5750353

SCHEMBL5750353

O=C(NC(Cc1cccc(C(=O)C(F)(F)C(F)F)c1)C(O)c1ccc(F)cc1)c1cccc2c(Cl)cccc12

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DGAT2 Q96PD7 3/20 0.36
MAPT P10636 1/20 0.35
P2RX7 Q99572 6/20 0.35
THRB P10828 1/20 0.35
BACE1 P56817 2/20 0.33
CCR1 P32246 2/20 0.31
CTSV O60911 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CTSS P25774 1/20 0.31

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
SCHEMBL5754762 0.92 DGAT2 (0.36) DGAT2MAPTP2RX7THRBBACE1
SCHEMBL5752859 0.89 BACE1 (0.34) DGAT2BACE1CTSLCTSBCTSS
SCHEMBL5753487 0.86 MAPT (0.36) DGAT2MAPTP2RX7THRBBACE1
SCHEMBL5750976 0.85 CETP (0.38) DGAT2MAPTP2RX7THRBBACE1
SCHEMBL5751322 0.81 ITGB1 (0.41) DGAT2MAPTP2RX7
SCHEMBL5749361 0.81 BACE1 (0.34) DGAT2BACE1CTSLCTSBCTSS
SCHEMBL5754301 0.79 ITGB1 (0.38) DGAT2MAPTP2RX7THRBBACE1
SCHEMBL5749779 0.76 CETP (0.40) BACE1
SCHEMBL5753763 0.76 MCHR1 (0.40) DGAT2P2RX7
SCHEMBL5751747 0.75 MCHR1 (0.34) DGAT2BACE1CTSVCTSLCTSB

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 DGAT2 206/4885MAPT 2688/4885P2RX7 4828/4885

“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.