SCHEMBL6779935

SCHEMBL6779935

CCOC(=O)/C=C(/c1ccc(C(=O)N(CC)CC)cc1)c1cccc(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 4/20 0.53
OPRM1 P35372 3/20 0.53
HPGD P15428 2/20 0.49
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL6779941 1.00 OPRD1 (0.53) OPRD1OPRM1HPGDLMNATSHR
SCHEMBL6897029 0.88 CES2 (0.54) TSHRNPC1ALDH1A1MAPTRAB9A
SCHEMBL7269978 0.82 OPRD1 (0.56) OPRD1OPRM1HPGDLMNATSHR
SCHEMBL7269968 0.82 OPRD1 (0.56) OPRD1OPRM1HPGDLMNATSHR
SCHEMBL7270787 0.81 OPRD1 (0.54) OPRD1OPRM1HPGDLMNATSHR
SCHEMBL7262597 0.81 OPRD1 (0.54) OPRD1OPRM1HPGDLMNATSHR
SCHEMBL1868573 0.80 HPGD (0.71) OPRD1OPRM1HPGDLMNATSHR
SCHEMBL6774036 0.80 OPRD1 (0.53) OPRD1OPRM1HPGDLMNATSHR
SCHEMBL6774035 0.80 OPRD1 (0.53) OPRD1OPRM1HPGDLMNATSHR
SCHEMBL1987981 0.79 HPGD (0.65) OPRD1OPRM1HPGDLMNATSHR

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-6790854-B2 TREATMENT OF DEPRESSION, EPILEPSY AND PARKINSON'S ISEASE, ANALGESICS MEIJI SEIKA KAISHA, LTD. (JP) 2004-09-14 US disclosed
US-20030176693-A1 Diphenylalkylamine derivatives useful as opioid receptor agonists MEIJI SEIKA KAISHA, LTD. (JP) 2003-09-18 US disclosed
EP-1277737-A1 DIPHENYLALKYLAMINE DERIVATIVES USEFUL AS OPIOID DELTA RECEPTOR AGONISTS MEIJI SEIKA KAISHA LTD. (JP) 2003-01-22 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-20030176693-A1 Diphenylalkylamine derivatives useful as opioid receptor agonists OPRM1, OPRK1, OPRL1 OPRD1 4/4885OPRM1 1/4885HPGD 2122/4885

“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.