SCHEMBL6762044

SCHEMBL6762044

CN(C)CCCN1CCN(C=O)CC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.38
PIM1 P11309 1/20 0.38
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
HTR3E A5X5Y0 1/20 0.34
SLC22A2 O15244 1/20 0.34
SLC22A1 O15245 1/20 0.34
CACNA1F O60840 1/20 0.34
SLC22A3 O75751 1/20 0.34
HTR3B O95264 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PRNP P04156 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
HTR1A P08908 1/20 0.34
CHRM5 P08912 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
CYP2D6 P10635 1/20 0.34
CHRM1 P11229 1/20 0.34

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
SCHEMBL3813922 0.88 HSD17B10 (0.40) HSD17B10PIM1LMNAMAPTALDH1A1
SCHEMBL6848265 0.84 HSD17B10 (0.35) HSD17B10MAPTALDH1A1KDM4EBDKRB1
SCHEMBL9434876 0.83 ALOX15 (0.50) ALOX15PIM1LMNAMAPTHTR3E
SCHEMBL27699518 0.83
SCHEMBL5574053 0.81 HSD17B10 (0.47) HSD17B10HTR1AKCNH2
SCHEMBL4915224 0.78 GNAI3 (0.44) HSD17B10LMNACHRM2CHRM4HTR1A
SCHEMBL7029723 0.77 ALOX15 (0.46) ALOX15PIM1LMNAMAPTHTR3E
SCHEMBL4901796 0.76 GNAI3 (0.52) HSD17B10LMNAHTR1AKCNH2KDM4E
Hydrochloric Acid SCHEMBL29165064 0.76 GNAI3 (0.47) HSD17B10LMNACHRM2CHRM4HTR1A
SCHEMBL7644458 0.75 ALOX15 (0.45) ALOX15PIM1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275555-A1 Substituted indole ligands for the ORL-1 receptor BRANE DISCOVERY S.R.L. (IT) 2009-11-05 US disclosed
US-20090275555-A1 Substituted indole ligands for the ORL-1 receptor BRANE DISCOVERY S.R.L. (IT) 2009-11-05 US disclosed
US-20040192680-A1 Novel amides that activate soluble guanylate cyclase ABBOTT LABORATORIES 2004-09-30 US disclosed
US-20040121994-A1 Novel amides that activate soluble guanylate cyclase ABBOTT LABORATORIES 2004-06-24 US disclosed
US-20040048866-A1 Indazole derivatives that are activators of soluble guanylate cyclase ABBOTT LABORATORIES 2004-03-11 US disclosed
WO-2003076408-A2 INDAZOLE DERIVATIVES THAT ARE ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE ABBOTT LABORATORIES (US) 2003-09-18 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 (4 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-20090275555-A1 Substituted indole ligands for the ORL-1 receptor OGFRL1, OPRL1, ORMDL3 ALOX15 1037/4885HSD17B10 2560/4885PIM1 2585/4885
US-20040048866-A1 Indazole derivatives that are activators of soluble guanylate cyclase GUCY1B1, GUCY1A1, GUCY1A2 ALOX15 1565/4885HSD17B10 2745/4885PIM1 566/4885
US-20040121994-A1 Novel amides that activate soluble guanylate cyclase GUCY1A1, GUCY1B1, GUCY1A2 ALOX15 1453/4885HSD17B10 2137/4885PIM1 2713/4885
US-20040192680-A1 Novel amides that activate soluble guanylate cyclase GUCY1A1, GUCY1B1, GUCY1A2 ALOX15 1453/4885HSD17B10 2137/4885PIM1 2713/4885

“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.