SCHEMBL10186290

SCHEMBL10186290

Cc1cc(C(=O)NCCNC(=O)c2ccc(O[C@H]3CC[C@@H](CC(=O)O)CC3)cc2)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.46
▸ CCR3 P51677 1/20 0.44
▸ HRH3 Q9Y5N1 4/20 0.42
▸ UTS2R Q9UKP6 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HPGD P15428 1/20 0.40
▸ ACSL1 P33121 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ EPHX2 P34913 1/20 0.40
▸ MAPK14 Q16539 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ F10 P00742 1/20 0.40

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
SCHEMBL662784 0.88 DGAT1 (0.46) CCR3HRH3POLBKMT2AHPGD
SCHEMBL10185451 0.88 DGAT1 (0.46) CCR3HRH3POLBKMT2AHPGD
SCHEMBL662783 0.88 DGAT1 (0.46) CCR3HRH3POLBKMT2AHPGD
SCHEMBL10186452 0.86 FAAH (0.47) FFAR4HRH3KMT2AEPHX2
SCHEMBL10186448 0.86 FAAH (0.47) FFAR4HRH3KMT2AEPHX2
SCHEMBL10186181 0.84 DGAT1 (0.47) DRD4
SCHEMBL10185477 0.84 CCR3 (0.42) CCR3HRH3UTS2RHPGDLMNA
SCHEMBL10185480 0.84 CCR3 (0.42) CCR3HRH3UTS2RHPGDLMNA
SCHEMBL13117660 0.82 CCR3 (0.42) CCR3HRH3UTS2RPOLBKMT2A
SCHEMBL660935 0.82 DGAT1 (0.55) KMT2AACSL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-23 — — US disclosed
WO-2010122968-A1 DIACYLETHYLENEDIAMINE COMPOUND アステラス製薬株式会社 (JP) 2010-10-28 — — WO 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 FFAR4 1053/4885CCR3 4296/4885HRH3 2422/4885

“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.

Send feedback