SCHEMBL21362324

SCHEMBL21362324

c1ccc(Oc2cc(Oc3cccc(-n4ccnc4)c3)c3oc4ccccc4c3c2)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
NOS2 P35228 1/20 0.39
GRM5 P41594 1/20 0.37
F10 P00742 2/20 0.37
F2 P00734 1/20 0.37
FFAR4 Q5NUL3 1/20 0.36
PTGS2 P35354 1/20 0.36
CYP19A1 P11511 2/20 0.36
IDO1 P14902 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
CYP3A4 P08684 3/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP1A2 P05177 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.33

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
SCHEMBL21362326 0.96 NPC1 (0.40) NPC1MAPTNOS2GRM5F10
SCHEMBL21362350 0.91 NOS2 (0.39) NPC1MAPTNOS2GRM5F10
SCHEMBL21362373 0.85 NPC1 (0.41) NPC1MAPTNOS2GRM5FFAR4
SCHEMBL21362369 0.82 TSHR (0.39) NPC1MAPTNOS2F10F2
SCHEMBL21362345 0.81 CYP3A4 (0.33) NPC1MAPTNOS2F10F2
SCHEMBL21362325 0.80 CYP11B1 (0.40) NPC1MAPTNOS2F10F2
SCHEMBL21362327 0.79 NPC1 (0.53) NPC1MAPTNOS2F10CYP19A1
SCHEMBL21362323 0.79 MAPT (0.38) NPC1MAPTGRM5FFAR4PTGS2
SCHEMBL21362375 0.78 TSHR (0.40) NPC1MAPTNOS2PTGS2CYP19A1
SCHEMBL21362371 0.73 NPC1 (0.48) NPC1MAPTGRM5FFAR4PTGS2

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-20190288223-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-19 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-20190288223-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME TPO, RPLP0, RPS10 NPC1 4210/4885MAPT 463/4885NOS2 1192/4885

“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.