SCHEMBL6796489

SCHEMBL6796489

C=CCN1CC(C)N(C)CC1C

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 6/20 0.47
MAPT P10636 1/20 0.45
CYP1A2 P05177 3/20 0.34
CYP3A4 P08684 3/20 0.34
CYP2C9 P11712 3/20 0.34
HPGD P15428 3/20 0.34
KDM4E B2RXH2 2/20 0.34
CYP2C19 P33261 2/20 0.34
OPRM1 P35372 1/20 0.31
OPRK1 P41145 1/20 0.31
SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL18661822 1.00 OPRD1 (0.47) OPRD1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL3851995 0.87
SCHEMBL3983864 0.77 OPRD1 (0.43) OPRD1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL12828282 0.73 SIGMAR1 (0.34) MAPTSIGMAR1
SCHEMBL6919165 0.72 OPRD1 (0.46) OPRD1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL4598449 0.72 OPRD1 (0.46) OPRD1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL13993922 0.72 MAPT (0.43) OPRD1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL4598452 0.72 OPRD1 (0.46) OPRD1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL24759193 0.71 HTT (0.33)
SCHEMBL23716614 0.71 HTT (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040138228-A1 Novel compounds with analgesic effect ASTRAZENECA CANADA INC. 2004-07-15 US disclosed
EP-1408037-A1 Novel diarylmethylpiperazine and diarylmethylphenyl compounds with analgesic effect AstraZeneca AB (SE) 2004-04-14 EP disclosed
US-6680321-B1 4-((1-PIPERAZINYLMETHYL)-BENZAMIDE DERIVATIVES; HYPOTENSIVE AGENTS; IMMUNOMODULATORS ASTRAZENECA CANADA, INC. (CA) 2004-01-20 US disclosed
US-6130222-A Compounds with analgesic effect ASTRA PHARMA INC. (CA) 2000-10-10 US disclosed
EP-0915855-A1 NOVEL COMPOUNDS WITH ANALGESIC EFFECT Astra Pharma Inc. (CA) 1999-05-19 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-20040138228-A1 Novel compounds with analgesic effect OPRL1, OPRK1, OPRM1 OPRD1 4/4885MAPT 2353/4885CYP1A2 497/4885

“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.