SCHEMBL10186309

SCHEMBL10186309

O=C(NCCNC(=O)c1ccc(Cl)s1)c1ccc2cc(O[C@H]3CC[C@@H](C(=O)O)CC3)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 2/20 0.42
▸ DGAT1 O75907 8/20 0.42
▸ MAPK1 P28482 1/20 0.41
▸ F2 P00734 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.40
▸ ACHE P22303 1/20 0.40
▸ CCR3 P51677 1/20 0.39
▸ ACSL1 P33121 3/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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
SCHEMBL10184880 0.91 DGAT1 (0.49) F10DGAT1MAPK1F2HRH3
SCHEMBL10185146 0.85 MAPK1 (0.42) F10DGAT1MAPK1F2HRH3
SCHEMBL10186303 0.85 F10 (0.47) F10DGAT1MAPK1F2HRH3
SCHEMBL10184557 0.85 F10 (0.47) F10DGAT1MAPK1F2HRH3
SCHEMBL10185798 0.84 DGAT1 (0.52) DGAT1HRH3ACHEACSL1RAB9A
SCHEMBL10186251 0.83 F10 (0.42) F10DGAT1MAPK1F2
SCHEMBL10184505 0.83 HRH3 (0.43) F10DGAT1MAPK1F2HRH3
SCHEMBL10185788 0.83 CCR3 (0.45) DGAT1HRH3ACHECCR3ACSL1
SCHEMBL10186199 0.83 DGAT1 (0.46) DGAT1HRH3NPC1
SCHEMBL10186248 0.81 MAPK1 (0.41) F10DGAT1MAPK1F2

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 F10 3477/4885DGAT1 1/4885MAPK1 2553/4885

“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.

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