SCHEMBL10148472

SCHEMBL10148472

COC(=O)[C@H]1CC[C@@H](Oc2ccc(C(C)=O)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47
RAB9A P51151 2/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
PARP10 Q53GL7 1/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 1/20 0.41
NPC1 O15118 1/20 0.40
MEN1 O00255 1/20 0.39
EPHX2 P34913 3/20 0.39
ALDH1A1 P00352 2/20 0.39
FURIN P09958 1/20 0.39
TSHR P16473 1/20 0.39
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL10148461 1.00 SMN1; SMN2 (0.47) SMN1; SMN2LMNARAB9AMAPTHPGD
SCHEMBL14984454 0.91 SMN1; SMN2 (0.49) SMN1; SMN2LMNARAB9AMAPTHPGD
SCHEMBL10148457 0.89 ALDH1A1 (0.51) LMNAEPHX2ALDH1A1
SCHEMBL10148464 0.89 ALDH1A1 (0.51) LMNAEPHX2ALDH1A1
SCHEMBL601885 0.81 PARP10 (0.45) SMN1; SMN2RAB9APARP10KMT2ANPC1
SCHEMBL601886 0.81 PARP10 (0.45) SMN1; SMN2RAB9APARP10KMT2ANPC1
SCHEMBL17873483 0.81 LMNA (0.61) SMN1; SMN2LMNARAB9AMAPTHPGD
SCHEMBL10188555 0.80 LMNA (0.53) SMN1; SMN2LMNARAB9AMAPTHPGD
SCHEMBL10186405 0.80 LMNA (0.51) SMN1; SMN2LMNARAB9AMAPTHPGD
SCHEMBL10186127 0.80 LMNA (0.51) SMN1; SMN2LMNARAB9AMAPTHPGD

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 2889/4885RAB9A 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.