SCHEMBL10148307

SCHEMBL10148307

COC(=O)C[C@H]1CC[C@@H](Oc2ccc(C(C)=O)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
PARP10 Q53GL7 1/20 0.43
POLB P06746 1/20 0.41
EPHX2 P34913 5/20 0.41
FAAH O00519 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ACACB O00763 2/20 0.40
MAPK1 P28482 1/20 0.40
GAA P10253 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
SCHEMBL10148308 0.89 EPHX2 (0.53) LMNAPARP10EPHX2FAAH
SCHEMBL12440598 0.86 EPHX2 (0.42) PARP10EPHX2FAAHACACB
SCHEMBL17873483 0.83 LMNA (0.61) SMN1; SMN2LMNAPARP10POLBEPHX2
SCHEMBL14127724 0.82 CYP19A1 (0.46) EPHX2MAPTL3MBTL1
SCHEMBL14235504 0.82 CYP19A1 (0.46) EPHX2MAPTL3MBTL1
SCHEMBL10186118 0.81 LMNA (0.48) SMN1; SMN2LMNAEPHX2FAAHMAPT
SCHEMBL13117542 0.81 LMNA (0.51) SMN1; SMN2LMNAPOLBEPHX2MAPT
SCHEMBL10184281 0.80 KDM4E (0.47) SMN1; SMN2LMNAEPHX2FAAHMAPT
SCHEMBL10185038 0.80 KDM4E (0.47) SMN1; SMN2LMNAEPHX2FAAHMAPT
SCHEMBL15043518 0.80 ALDH1A1 (0.48) LMNAMAPTMAPK1

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 SMN1; SMN2 4464/4885LMNA 2889/4885PARP10 1704/4885

“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.