SCHEMBL22158503

SCHEMBL22158503

N#Cc1cc(-n2c3ccc(-c4ncccn4)cc3c3cc(-c4ncccn4)ccc32)c(-n2c3ccc(-c4ncccn4)cc3c3cc(-c4ncccn4)ccc32)cc1-c1cc(F)cc(F)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SSTR2 P30874 6/20 0.37
SCN9A Q15858 3/20 0.36
GRM5 P41594 1/20 0.36
CLK4 Q9HAZ1 1/20 0.35
HTR1A P08908 1/20 0.35
DRD4 P21917 1/20 0.35
HTR1B P28222 1/20 0.35
DRD3 P35462 1/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
SSTR4 P31391 1/20 0.35
CYP11B2 P19099 1/20 0.34
NR3C1 P04150 1/20 0.34
CYP3A4 P08684 1/20 0.34
SSTR3 P32745 1/20 0.34
KCNH2 Q12809 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
SCHEMBL22158505 0.96 SSTR2 (0.36) SSTR2SCN9AGRM5CLK4HTR1A
SCHEMBL22156418 0.92 SSTR2 (0.36) SSTR2SCN9AGRM5CLK4HTR1A
SCHEMBL22158502 0.91 SCN9A (0.38) SSTR2SCN9AGRM5CLK4CYP2C9
SCHEMBL22158278 0.89 SSTR2 (0.36) SSTR2GRM5CLK4HTR1ADRD4
SCHEMBL22157065 0.89 SCN9A (0.36) SSTR2SCN9AGRM5CLK4CYP11B2
SCHEMBL22157067 0.88 SSTR2 (0.38) SSTR2CYP2C9CYP2C19SSTR4CYP11B2
SCHEMBL22157196 0.86 CLK4 (0.35) CLK4HTR1ADRD4HTR1BDRD3
SCHEMBL22156568 0.85 CLK4 (0.37) SSTR2CLK4HTR1ADRD4HTR1B
SCHEMBL22156815 0.85 SSTR2 (0.36) SSTR2CLK4CYP2C9CYP2C19SSTR4
SCHEMBL22156816 0.85 CYP11B1 (0.38) SSTR2CYP11B2NR3C1

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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-25 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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 SSTR2 911/4885SCN9A 2553/4885GRM5 3723/4885

“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.