SCHEMBL21360460

SCHEMBL21360460

NCCN(Cc1ccc(Cl)s1)c1ccccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 5/20 0.46
CHRM2 P08172 4/20 0.46
ADRA2A P08913 4/20 0.46
DRD1 P21728 4/20 0.46
SLC6A4 P31645 4/20 0.46
SLC6A3 Q01959 4/20 0.46
KCNH2 Q12809 4/20 0.46
SLC6A2 P23975 3/20 0.46
CYP1A2 P05177 3/20 0.46
OPRM1 P35372 3/20 0.46
HTR2A P28223 3/20 0.46
HRH1 P35367 3/20 0.46
CHRM1 P11229 2/20 0.46
ADRA2B P18089 2/20 0.46
HTR2C P28335 2/20 0.46
HTR2B P41595 2/20 0.46
CHRM5 P08912 1/20 0.46
CYP2C9 P11712 1/20 0.46
NFKB1 P19838 1/20 0.46
HTR6 P50406 1/20 0.46

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
SCHEMBL10749933 0.92 CYP2D6 (0.44) CYP2D6CHRM2ADRA2ADRD1SLC6A4
Chlorothen SCHEMBL29707 0.85 CYP2D6 (0.64) CYP2D6CHRM2ADRA2ADRD1SLC6A4
Chlorothen SCHEMBL29521748 0.84 KDM4E (0.65) CYP2D6CHRM2ADRA2ADRD1SLC6A4
SCHEMBL18912921 0.83 CYP2D6 (0.43) CYP2D6CHRM2ADRA2ADRD1SLC6A4
SCHEMBL7297232 0.78 CYP2D6 (0.73) CYP2D6CHRM2ADRA2ADRD1SLC6A4
SCHEMBL9866638 0.76 CYP2D6 (0.72) CYP2D6CHRM2ADRA2ADRD1SLC6A4
SCHEMBL7095181 0.75 CHRM2 (0.69) CYP2D6CHRM2ADRA2ADRD1SLC6A4
SCHEMBL10749349 0.74 SSTR4 (0.35) CYP2D6CHRM2ADRA2ADRD1SLC6A4
Chlorothen SCHEMBL1649730 0.73 LMNA (0.71) CYP2D6CHRM2ADRA2ADRD1SLC6A4
SCHEMBL10674626 0.70 CYP2D6 (0.70) CYP2D6CHRM2ADRA2ADRD1SLC6A4

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-10413487-B2 Nail gel polish and its manufacturing method Shanghai O'Nine Technologies Ltd. (CN) 2019-09-17 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-10413487-B2 Nail gel polish and its manufacturing method POLR1C, NACA, PRKDC CYP2D6 2473/4885CHRM2 4061/4885ADRA2A 2628/4885

“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.