SCHEMBL10148448

SCHEMBL10148448

CC(=O)c1ccc(OC2CCC3(CC2)OCCO3)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 2/20 0.55
POLB P06746 1/20 0.47
GPR119 Q8TDV5 2/20 0.46
PARP10 Q53GL7 1/20 0.45
MAPT P10636 2/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MAPK1 P28482 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL10148450 0.88 ALDH1A1 (0.53) LMNAPOLBGPR119PARP10ALDH1A1
SCHEMBL17873483 0.82 LMNA (0.61) SMN1; SMN2LMNAPOLBPARP10MAPT
SCHEMBL18234093 0.81 L3MBTL1 (0.37) LMNAPOLBGPR119ALDH1A1L3MBTL1
SCHEMBL10184311 0.81 LMNA (0.51) SMN1; SMN2LMNAPOLBGPR119MAPT
SCHEMBL14505028 0.79 PARP10 (0.64) SMN1; SMN2LMNAPARP10MAPTHPGD
SCHEMBL2016327 0.78 EPHX2 (0.39) SMN1; SMN2POLBGPR119PARP10MAPT
SCHEMBL5521884 0.78 SLC6A4 (0.46) LMNAPOLBALDH1A1KMT2A
SCHEMBL148028 0.78 HRH1 (0.50) SMN1; SMN2POLBALDH1A1L3MBTL1
SCHEMBL30837228 0.78 MAP4K4 (0.56) SMN1; SMN2LMNAPARP10MAPTHPGD
SCHEMBL662856 0.78 FAAH (0.51) SMN1; SMN2LMNAMAPTHPGDRAB9A

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 2889/4885POLB 3114/4885

“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.