SCHEMBL22158277

SCHEMBL22158277

N#Cc1cc(-n2c3ccccc3c3ccc(-c4ncccn4)cc32)c(-c2cc(F)cc(F)c2)cc1-n1c2ccccc2c2ccc(-c3ncccn3)cc21

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SSTR2 P30874 2/20 0.35
GRM5 P41594 3/20 0.33
CYP11B2 P19099 2/20 0.33
CYP11B1 P15538 1/20 0.33
SCN9A Q15858 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
SQOR Q9Y6N5 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
NR3C1 P04150 1/20 0.32
METAP2 P50579 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP2C9 P11712 1/20 0.31
SSTR4 P31391 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL23299783 0.97 GRM5 (0.35) SSTR2GRM5CYP11B2CYP11B1SCN9A
SCHEMBL22157065 0.94 SCN9A (0.36) SSTR2GRM5CYP11B2CYP11B1SCN9A
SCHEMBL22158278 0.94 SSTR2 (0.36) SSTR2GRM5CYP11B2CYP11B1GABRA1
SCHEMBL22156418 0.90 SSTR2 (0.36) SSTR2GRM5CYP11B2CYP11B1SCN9A
SCHEMBL22158273 0.90 SSTR2 (0.35) SSTR2CYP11B2CYP11B1SQORCLK4
SCHEMBL22158502 0.89 SCN9A (0.38) SSTR2GRM5CYP11B2SCN9AGABRA1
SCHEMBL22158505 0.88 SSTR2 (0.36) SSTR2GRM5CYP11B2CYP11B1SCN9A
SCHEMBL22156387 0.88 CYP11B2 (0.33) CYP11B2CYP11B1SQORCLK4NR3C1
SCHEMBL22158275 0.87 SSTR2 (0.36) SSTR2CYP11B2CYP11B1SQORCLK4
SCHEMBL22156564 0.87 CYP11B1 (0.36) SSTR2CYP11B2CYP11B1SQORNR3C1

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 911/4885GRM5 3723/4885CYP11B2 531/4885

“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.