SCHEMBL6858868

SCHEMBL6858868

Clc1ccc2c(c1)N(CCCBr)c1ccccc1S2

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 5/20 0.70
CYP2C19 P33261 5/20 0.70
LMNA P02545 4/20 0.70
CYP1A2 P05177 4/20 0.70
HTR1A P08908 4/20 0.70
MAPT P10636 4/20 0.70
DRD2 P14416 4/20 0.70
SMN1; SMN2 Q16637 4/20 0.70
TDP1 Q9NUW8 3/20 0.70
ABCB11 O95342 3/20 0.70
TP53 P04637 3/20 0.70
CYP3A4 P08684 3/20 0.70
ADRA2A P08913 3/20 0.70
ADRA2B P18089 3/20 0.70
ADRA2C P18825 3/20 0.70
NFKB1 P19838 3/20 0.70
SLC6A2 P23975 3/20 0.70
HTR2A P28223 3/20 0.70
HTR2C P28335 3/20 0.70
MAPK1 P28482 3/20 0.70

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
SCHEMBL30934895 1.00 CYP2D6 (0.70) CYP2D6CYP2C19LMNACYP1A2HTR1A
SCHEMBL29724166 0.87 CYP2D6 (0.71) CYP2D6CYP2C19LMNACYP1A2HTR1A
SCHEMBL8053156 0.87 CYP2D6 (0.71) CYP2D6CYP2C19LMNACYP1A2HTR1A
SCHEMBL3770165 0.86 PIM1 (0.66) CYP2D6CYP2C19LMNACYP1A2HTR1A
SCHEMBL30349813 0.86 CYP2D6 (0.70) CYP2D6CYP2C19LMNACYP1A2HTR1A
Nor2-Chlorpromazine SCHEMBL11202527 0.86 LMNA (0.70) CYP2D6CYP2C19LMNACYP1A2HTR1A
SCHEMBL14292494 0.86 LMNA (0.74) CYP2D6CYP2C19LMNACYP1A2HTR1A
SCHEMBL7066913 0.86 CYP2D6 (0.70) CYP2D6CYP2C19LMNACYP1A2HTR1A
SCHEMBL21436140 0.86 CYP2D6 (0.70) CYP2D6CYP2C19LMNACYP1A2HTR1A
SCHEMBL14292497 0.84 LMNA (0.72) CYP2D6CYP2C19LMNACYP1A2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118105488-A Diagnosis and treatment prodrug for inducing tumor stem cell apoptosis as well as preparation method and application thereof 东南大学 2024-05-31 CN disclosed
WO-2003062388-A9 INHIBITION OF RNA FUNCTION UNIV CALIFORNIA (US) 2004-05-27 WO disclosed
US-20030229082-A1 Inhibition of RNA function THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-12-11 US disclosed
WO-2003062388-A2 INHIBITION OF RNA FUNCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2003-07-31 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 (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-20030229082-A1 Inhibition of RNA function OPRM1, EFTUD2, POLRMT CYP2D6 2880/4885CYP2C19 2655/4885LMNA 2240/4885

“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.