SCHEMBL4519711

SCHEMBL4519711

COC(=O)C1=CCCN(CCN2CCCCC2)C1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 3/20 0.60
LMNA P02545 3/20 0.60
CHRM2 P08172 2/20 0.60
CHRM4 P08173 2/20 0.60
CHRM5 P08912 2/20 0.60
CHRM1 P11229 2/20 0.60
THRB P10828 1/20 0.60
BLM P54132 2/20 0.59
MCOLN3 Q8TDD5 1/20 0.59
OPRK1 P41145 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 3/20 0.44
GLA P06280 1/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CYP1A2 P05177 3/20 0.43
CYP2D6 P10635 3/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
KMT2A Q03164 2/20 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
SCHEMBL4511928 0.88 LMNA (0.65) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL4514388 0.87 LMNA (0.59) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL4509743 0.85 LMNA (0.64) CHRM3LMNACHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL10419888 0.84 LMNA (0.62) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL4520047 0.84 LMNA (0.62) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL3843644 0.81 SLC6A1 (0.55) LMNABLMKDM4ECYP1A2CYP2D6
Hydrochloric Acid SCHEMBL9702237 0.80 CHRM3 (0.61) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL6551639 0.80 LMNA (0.57) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL10874466 0.79 LMNA (0.56) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL4516519 0.78 LMNA (0.48) CHRM3LMNACHRM2CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298813-A1 USE OF NEUROPROTECTIVE COMPOUNDS IN OBTAINING MEDICAMENTS INTENDED FOR THE TREATMENT OF NEURODEGENERATING DISEASES LES LABORATOIRES SERVIER (FR) 2009-12-03 US disclosed
US-20090258883-A1 1H-Indole-Pyridinecarboxamide and 1H-Indole-Piperidinecarboxamide Compounds LES LABORATOIRES SERVIER (FR) 2009-10-15 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 (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-20090298813-A1 USE OF NEUROPROTECTIVE COMPOUNDS IN OBTAINING MEDICAMENTS INTENDED FOR THE TREATMENT OF NEURODEGENERATING DISEASES NLN, GAP43, SNCA CHRM3 727/4885LMNA 498/4885CHRM2 977/4885
US-20090258883-A1 1H-Indole-Pyridinecarboxamide and 1H-Indole-Piperidinecarboxamide Compounds IDO1, AHR, IDO2 CHRM3 246/4885LMNA 2200/4885CHRM2 314/4885

“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.