SCHEMBL10186265

SCHEMBL10186265

O=C(NCCNC(=O)c1ccc(O[C@H]2CC[C@@H](C(=O)O)CC2)cc1F)c1cc2cc(Cl)ccc2s1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 3/20 0.41
CLK1 P49759 5/20 0.41
CLK2 P49760 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
HRH3 Q9Y5N1 1/20 0.39
CHRNA7 P36544 2/20 0.38
HTR3A P46098 2/20 0.38
PRSS12 P56730 1/20 0.38
DGAT1 O75907 4/20 0.37
SOAT1 P35610 2/20 0.37
MMP12 P39900 1/20 0.37
CNR2 P34972 1/20 0.37
CHRM4 P08173 1/20 0.35

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
SCHEMBL10185104 0.93 PRSS12 (0.44) UTS2RHRH3CHRNA7PRSS12DGAT1
SCHEMBL10185144 0.91 CLK1 (0.42) UTS2RCLK1CLK2CLK4HRH3
SCHEMBL662828 0.91 CLK1 (0.42) UTS2RCLK1CLK2CLK4HRH3
SCHEMBL662829 0.91 CLK1 (0.42) UTS2RCLK1CLK2CLK4HRH3
SCHEMBL10185736 0.90 UTS2R (0.42) UTS2RCLK1CLK2CLK4CHRNA7
SCHEMBL10185434 0.89 RAB9A (0.44) CLK1HRH3DGAT1
SCHEMBL10185350 0.88 UTS2R (0.45) UTS2RCLK1CLK2CLK4CHRNA7
SCHEMBL10184512 0.87 UTS2R (0.47) UTS2RCLK1CLK2CLK4CHRNA7
SCHEMBL10185239 0.87 UTS2R (0.44) UTS2RCLK1CLK2CLK4CHRNA7
SCHEMBL10184525 0.86 DGAT1 (0.40) UTS2RCLK1CLK2HRH3CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-23 US 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-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND DGAT1, DGAT2, DIMT1 UTS2R 2678/4885CLK1 2402/4885CLK2 1948/4885

“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.