SCHEMBL3308491

SCHEMBL3308491

CCCn1c2c(c3cc(NC(=O)C4CCCCC4)ccc31)CN(C1CCOCC1)CC2

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 17/20 0.62
KCNH2 Q12809 6/20 0.51
CNR2 P34972 1/20 0.47
GBA1 P04062 1/20 0.43
GLA P06280 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL3308494 0.99 CNR1 (0.62) CNR1KCNH2CNR2
SCHEMBL3311826 0.97 CNR1 (0.62) CNR1KCNH2CNR2GBA1GLA
SCHEMBL3308026 0.96 CNR1 (0.64) CNR1KCNH2CNR2
SCHEMBL13329723 0.93 CNR1 (0.63) CNR1KCNH2ALDH1A1HPGDNPC1
SCHEMBL13329718 0.91 CNR1 (0.63) CNR1KCNH2CNR2ALDH1A1NPC1
SCHEMBL3312043 0.90 CNR1 (0.62) CNR1KCNH2CNR2ALDH1A1HPGD
SCHEMBL5613533 0.85 CNR1 (0.56) CNR1KCNH2CNR2ALDH1A1NPC1
SCHEMBL13329716 0.83 CNR1 (0.64) CNR1KCNH2CNR2ALDH1A1HPGD
SCHEMBL3311874 0.83 CNR1 (0.54) CNR1KCNH2ALDH1A1HPGDNPC1
SCHEMBL3311867 0.83 CNR1 (0.54) CNR1KCNH2ALDH1A1HPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100113502-A1 Novel Tetrahydro-1H-Pyrido[4,3-b] Indole Derivatives as CB1 Receptor Ligands ASTRAZENECA AB (SE) 2010-05-06 US claimed
EP-1863810-A1 NOVEL TETRAHYDRO-1H-PYRIDO [4,3-b] INDOLE DERIVATIVES AS CB1' RECEPTOR LIGANDS AstraZeneca AB (SE) 2007-12-12 EP claimed
WO-2006101434-A1 NOVEL TETRAHYDRO-1H-PYRIDO [4,3-b] INDOLE DERIVATIVES AS CB1’ RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2006-09-28 WO claimed
US-20100113502-A1 Novel Tetrahydro-1H-Pyrido[4,3-b] Indole Derivatives as CB1 Receptor Ligands ASTRAZENECA AB (SE) 2010-05-06 US disclosed
US-20100113502-A1 Novel Tetrahydro-1H-Pyrido[4,3-b] Indole Derivatives as CB1 Receptor Ligands ASTRAZENECA AB (SE) 2010-05-06 US disclosed
US-20100113502-A1 Novel Tetrahydro-1H-Pyrido[4,3-b] Indole Derivatives as CB1 Receptor Ligands ASTRAZENECA AB (SE) 2010-05-06 US disclosed
US-20100113276-A1 USE OF N2-PHENYLAMIDINES AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2010-05-06 US disclosed
EP-1863810-A1 NOVEL TETRAHYDRO-1H-PYRIDO [4,3-b] INDOLE DERIVATIVES AS CB1' RECEPTOR LIGANDS AstraZeneca AB (SE) 2007-12-12 EP disclosed
WO-2006101434-A1 NOVEL TETRAHYDRO-1H-PYRIDO [4,3-b] INDOLE DERIVATIVES AS CB1’ RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2006-09-28 WO 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 (2 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-20100113276-A1 USE OF N2-PHENYLAMIDINES AS HERBICIDES DDT, PAH, PFAS CNR1 2321/4885KCNH2 581/4885CNR2 2019/4885
US-20100113502-A1 Novel Tetrahydro-1H-Pyrido[4,3-b] Indole Derivatives as CB1 Receptor Ligands CNR1, CNR2, OPRL1 CNR1 1/4885KCNH2 856/4885CNR2 2/4885

“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.