SCHEMBL10148308

SCHEMBL10148308

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

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 14/20 0.53
FAAH O00519 4/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
SRD5A1 P18405 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
SRD5A2 P31213 1/20 0.43
PARP10 Q53GL7 1/20 0.43

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
SCHEMBL10148307 0.89 SMN1; SMN2 (0.49) EPHX2FAAHLMNAPARP10
SCHEMBL12440598 0.86 EPHX2 (0.42) EPHX2FAAHALDH1A1PARP10
SCHEMBL14235504 0.82 CYP19A1 (0.46) EPHX2
SCHEMBL14127724 0.82 CYP19A1 (0.46) EPHX2
SCHEMBL1977190 0.82 ALDH1A1 (0.70) EPHX2FAAHALDH1A1LMNACASP3
SCHEMBL10186118 0.81 LMNA (0.48) EPHX2FAAHLMNA
SCHEMBL13117542 0.81 LMNA (0.51) EPHX2ALDH1A1LMNA
SCHEMBL10185038 0.80 KDM4E (0.47) EPHX2FAAHALDH1A1LMNA
SCHEMBL10184281 0.80 KDM4E (0.47) EPHX2FAAHALDH1A1LMNA
SCHEMBL434831 0.80 ALDH1A1 (0.48) ALDH1A1LMNA

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 EPHX2 1718/4885FAAH 1026/4885ALDH1A1 963/4885

“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.