SCHEMBL10148426

SCHEMBL10148426

CCOC(=O)[C@H]1CC[C@@H](Oc2ccc3cc(C(=O)O)ccc3c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.49
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
HRH3 Q9Y5N1 6/20 0.44
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
TSHR P16473 1/20 0.43
ACSL1 P33121 1/20 0.42
GLA P06280 1/20 0.42
MAPT P10636 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL10148429 0.90 POLB (0.49) POLBKDM4ENPC1RAB9AHRH3
SCHEMBL10147939 0.88 POLB (0.57) POLBTSHRMAPTALDH1A1KMT2A
SCHEMBL241349 0.88 POLB (0.57) POLBTSHRMAPTALDH1A1KMT2A
SCHEMBL664676 0.88 POLB (0.57) POLBTSHRMAPTALDH1A1KMT2A
SCHEMBL10184995 0.85 LMNA (0.46) POLBNPC1RAB9AHRH3MAOA
SCHEMBL10148076 0.84 POLB (0.47) POLBKDM4ENPC1RAB9AMAOA
SCHEMBL10148015 0.81 GLA (0.48) POLBHRH3TSHRGLAMEN1
SCHEMBL10148190 0.80 ALDH1A1 (0.45) POLBKDM4ENPC1RAB9AMAOA
SCHEMBL10148067 0.79 ALDH1A1 (0.47) POLBKDM4ENPC1HRH3TSHR
SCHEMBL664684 0.79 TSHR (0.45) POLBKDM4ENPC1RAB9AMAOA

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-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-23 US disclosed
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 POLB 3114/4885KDM4E 3060/4885NPC1 201/4885

“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.