SCHEMBL10185204

SCHEMBL10185204

Cc1cccc(C(=O)NCCNC(=O)c2ccc(O[C@H]3CC[C@@H](C(=O)O)CC3)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACSL1 P33121 7/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
LMNA P02545 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
DGAT1 O75907 3/20 0.47
POLB P06746 2/20 0.47
F10 P00742 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 1/20 0.45

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
SCHEMBL10185044 0.89 LMNA (0.54) ACSL1NPC1LMNADGAT1POLB
SCHEMBL10184323 0.89 DGAT1 (0.56) NPC1RAB9ALMNADGAT1POLB
SCHEMBL664114 0.89 DGAT1 (0.56) NPC1RAB9ALMNADGAT1POLB
SCHEMBL664113 0.89 DGAT1 (0.56) NPC1RAB9ALMNADGAT1POLB
SCHEMBL10184414 0.88 DGAT1 (0.51) ACSL1NPC1RAB9ALMNADGAT1
SCHEMBL10185200 0.87 DGAT1 (0.46) ACSL1NPC1LMNADGAT1POLB
SCHEMBL10184899 0.87 RAB9A (0.54) NPC1RAB9ASMN1; SMN2DGAT1F10
SCHEMBL10184403 0.87 DGAT1 (0.54) LMNADGAT1MEN1KMT2A
SCHEMBL10186131 0.87 NPC1 (0.49) NPC1RAB9ASMN1; SMN2DGAT1
SCHEMBL10186145 0.87 DGAT1 (0.49) ACSL1SMN1; SMN2DGAT1F10MEN1

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 ACSL1 508/4885NPC1 201/4885RAB9A 1660/4885

“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.