SCHEMBL13813849

SCHEMBL13813849

N#Cc1ccc(-c2nc3sc(-c4ccc(C#N)cc4)nc3s2)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 3/20 0.49
▸ GAA P10253 1/20 0.44
▸ CDC25A P30304 1/20 0.44
▸ CDC25B P30305 1/20 0.44
▸ CDC25C P30307 1/20 0.44
▸ MMP3 P08254 1/20 0.43
▸ HRH3 Q9Y5N1 3/20 0.42
▸ ADORA3 P0DMS8 1/20 0.41
▸ ADORA2A P29274 1/20 0.41
▸ ADORA1 P30542 1/20 0.41
▸ F2RL3 Q96RI0 1/20 0.41
▸ CYP11B2 P19099 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ NOTUM Q6P988 1/20 0.40
▸ KIF11 P52732 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL26503260 0.82 AR (0.43) APPGAACDC25ACDC25BCDC25C
SCHEMBL23954281 0.79 KEAP1 (0.39) APPADORA3ADORA2AADORA1NPC1
SCHEMBL25028302 0.77 APP (0.68) APPGAANPC1RAB9A
SCHEMBL9629262 0.74 KDM4E (0.54) GAA
SCHEMBL25028048 0.74 APP (0.42) APPGAACDC25ACDC25BCDC25C
SCHEMBL6807684 0.74 APP (0.63) APPGAANPC1RAB9A
SCHEMBL29928086 0.74 APP (0.63) APPGAANPC1RAB9A
SCHEMBL17059006 0.72 APP (0.44) APPGAACDC25ACDC25BCDC25C
SCHEMBL2225287 0.72 PDPK1 (0.57) GAACDC25ACDC25BCDC25CMMP3
SCHEMBL16964229 0.72 GAA (0.50) APPGAACDC25ACDC25BCDC25C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230050869-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 — — US disclosed
US-20090156827-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS AND ORGANIC ELECTROLUMINESCENT ELEMENT TOYO INK MFG. CO., LTD. (JP) 2009-06-18 — — 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-20090156827-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS AND ORGANIC ELECTROLUMINESCENT ELEMENT ELP1, ELAVL1, ELF3 APP 3090/4885GAA 1544/4885CDC25A 3086/4885

“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.

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