SCHEMBL1556873

SCHEMBL1556873

CCC(=O)C(Cc1ccccc1)(CN(CC)CC)c1ccc(N2CCOCC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
OPRM1 P35372 1/20 0.43
OPRD1 P41143 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 4/20 0.42
HPGD P15428 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ESR1 P03372 1/20 0.39
ALDH1A1 P00352 2/20 0.39
RORC P51449 3/20 0.39
LMNA P02545 2/20 0.39
GSK3B P49841 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MDM2 Q00987 1/20 0.38
AOC3 Q16853 2/20 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
SCHEMBL14368114 0.80 SMN1; SMN2 (0.51) SMN1; SMN2OPRM1OPRD1L3MBTL1MAPT
SCHEMBL31127464 0.79 SMN1; SMN2 (0.46) SMN1; SMN2OPRM1OPRD1L3MBTL1MAPT
SCHEMBL172556 0.71 TMEM97 (0.45) SMN1; SMN2L3MBTL1MAPTMEN1KMT2A
SCHEMBL4376965 0.70 SMN1; SMN2 (0.48) SMN1; SMN2L3MBTL1MAPTMEN1KMT2A
SCHEMBL5635160 0.70 ALDH1A1 (0.48) SMN1; SMN2OPRM1OPRD1L3MBTL1MAPT
SCHEMBL1781930 0.70 SMN1; SMN2 (0.47) SMN1; SMN2L3MBTL1MAPTMEN1KMT2A
SCHEMBL27808128 0.70 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1MAPTMEN1KMT2A
SCHEMBL623433 0.69 SMN1; SMN2 (0.49) SMN1; SMN2L3MBTL1MAPTMEN1KMT2A
SCHEMBL7775203 0.69 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL1MAPTMEN1KMT2A
SCHEMBL28936310 0.69 SMN1; SMN2 (0.49) SMN1; SMN2L3MBTL1MAPTMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2305205-B1 DENTAL ADHESIVE COMPOSITION TOKUYAMA DENTAL CORP (JP) 2018-04-11 EP disclosed
US-8796354-B2 Dental adhesive composition TOKUYAMA DENTAL CORPORATION (JP) 2014-08-05 US disclosed
US-20110098375-A1 DENTAL ADHESIVE COMPOSITION TOKUYAMA DENTAL CORPORATION (JP) 2011-04-28 US disclosed
EP-2305205-A1 DENTAL ADHESIVE COMPOSITION Tokuyama Dental Corporation (JP) 2011-04-06 EP 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-20110098375-A1 DENTAL ADHESIVE COMPOSITION CAD, CDH1, ITGA4 SMN1; SMN2 3548/4885OPRM1 686/4885OPRD1 1930/4885

“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.