SCHEMBL5470879

SCHEMBL5470879

COc1ccccc1N1CCC(C#N)(c2cccc3ccccc23)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.48
DRD3 P35462 4/20 0.48
LMNA P02545 5/20 0.45
MAPT P10636 5/20 0.45
HTR1A P08908 5/20 0.45
MAPK1 P28482 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HIF1A Q16665 2/20 0.45
ADRB1 P08588 2/20 0.45
CYP2C19 P33261 2/20 0.45
NR1I2 O75469 1/20 0.45
NR3C1 P04150 1/20 0.45
ADRA2A P08913 1/20 0.45
ADRA2B P18089 1/20 0.45
ADRA2C P18825 1/20 0.45
DRD1 P21728 1/20 0.45
ACHE P22303 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
SCHEMBL5465339 0.87 DRD2 (0.55) DRD2DRD3LMNAMAPTTDP1
SCHEMBL4882594 0.80 DRD2 (0.55) DRD2DRD3LMNAMAPTHTR1A
SCHEMBL5465370 0.77 DRD2 (0.51) DRD2DRD3LMNAMAPTHTR1A
SCHEMBL5482306 0.76 KMT2A (0.51) DRD2DRD3LMNAMAPTHTR1A
SCHEMBL4870906 0.76 KMT2A (0.67) DRD2DRD3MAPTHTR1AKDM4E
SCHEMBL30344752 0.76 OPRL1 (0.46) MAPTMAPK1TDP1KDM4EMEN1
SCHEMBL8747153 0.76 OPRL1 (0.46) MAPTMAPK1TDP1KDM4EMEN1
SCHEMBL5478188 0.76 MAPT (0.51) DRD2DRD3LMNAMAPTHTR1A
SCHEMBL5476121 0.76 KMT2A (0.53) DRD2DRD3LMNAMAPTHTR1A
SCHEMBL5466054 0.75 DRD4 (0.52) DRD2DRD3LMNAMAPTHTR1A

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-20070078120-A1 Novel piperidine derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-05 US disclosed
EP-1679069-A1 NOVEL PIPERIDINE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-07-12 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-20070078120-A1 Novel piperidine derivative LDLR, PRMT5, MSR1 DRD2 551/4885DRD3 552/4885LMNA 1454/4885

“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.