SCHEMBL5753157

SCHEMBL5753157

O=C(NC(Cc1ccc(F)cc1)C(O)c1ccc(C(F)(F)F)cc1)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 1/20 0.41
CCR3 P51677 2/20 0.40
TSHR P16473 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
MEN1 O00255 1/20 0.39
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
FFAR2 O15552 1/20 0.39
TACR1 P25103 1/20 0.39
CCR5 P51681 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL5750265 1.00 UGCG (0.41) UGCGCCR3TSHRKMT2ALMNA
SCHEMBL5752726 0.99 UGCG (0.41) UGCGCCR3TSHRKMT2AMEN1
SCHEMBL5751759 0.92 RAB9A (0.42) UGCGTSHRKMT2ALMNACCR5
SCHEMBL5752625 0.88 ALDH1A1 (0.42) LMNARXFP1TACR1
SCHEMBL5752352 0.85 UGCG (0.52) UGCGCCR3FFAR2POLBRAB9A
SCHEMBL5749651 0.84 ACACB (0.48) CCR3KMT2ALMNAMEN1POLB
SCHEMBL5751627 0.83 UGCG (0.46) UGCGCCR3NOS3NOS1NOS2
SCHEMBL5752076 0.82 NOS3 (0.44) UGCGNOS3NOS1NOS2TACR1
SCHEMBL6580474 0.82 NOS3 (0.44) UGCGNOS3NOS1NOS2TACR1
SCHEMBL5752607 0.81 UGCG (0.41) UGCGLMNATACR1

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 UGCG 740/4885CCR3 2978/4885TSHR 3729/4885

“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.