SCHEMBL19429017

SCHEMBL19429017

CN(C)Cc1ccc2sc3c(CN(C)CN(C)C)cccc3c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
PIM1 P11309 6/20 0.37
PIM2 Q9P1W9 6/20 0.37
CA2 P00918 1/20 0.35
NR1I2 O75469 1/20 0.35
LMNA P02545 1/20 0.35
ADRA2A P08913 1/20 0.35
ACHE P22303 1/20 0.35
SLC6A2 P23975 1/20 0.35
HTR2A P28223 1/20 0.35
SLC6A4 P31645 1/20 0.35
KCNH2 Q12809 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
TNKS O95271 1/20 0.33
PARP1 P09874 1/20 0.33
PIM3 Q86V86 2/20 0.32
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL19429090 0.90 CYP2D6 (0.38) CYP2D6CYP1A2CYP2C19CA2NR1I2
SCHEMBL19429049 0.84 CYP2D6 (0.47) CYP2D6CYP1A2CYP2C19PIM1PIM2
SCHEMBL19429318 0.78 CYP2D6 (0.35) CYP2D6CYP1A2CYP2C19NR1I2LMNA
SCHEMBL19429087 0.78 GPR3 (0.42) CYP2D6CYP1A2LMNAHTR2ATSHR
SCHEMBL19429051 0.77 CA2 (0.39) PIM1PIM2CA2LMNASLC6A4
SCHEMBL19429012 0.77 CA2 (0.39) PIM1PIM2CA2LMNASLC6A4
SCHEMBL19429005 0.74 POLB (0.34) CYP2D6CYP1A2CYP2C19CA2NR1I2
SCHEMBL19239053 0.70 TSHR (0.41) CYP2D6CYP2C19PIM1PIM2CA2
SCHEMBL19429003 0.70 ALDH1A1 (0.44) CYP2D6PIM1PIM2LMNAHTR2A
SCHEMBL19429002 0.70 CYP2D6 (0.44) CYP2D6CYP1A2CYP2C19PIM1PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170288148-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT COMPRISING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2017-10-05 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 (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-20170288148-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT COMPRISING THE SAME, AND ELECTRONIC DEVICE THEREOF OCIAD1, GPX1, PIEZO1 CYP2D6 1799/4885CYP1A2 885/4885CYP2C19 817/4885

“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.