SCHEMBL21392544

SCHEMBL21392544

CCc1nc2ccccc2n1-c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccncc4)cc3)c3ccc(-c4ccc5c(-c6ccc(-c7cccnc7)cc6)c6ccccc6c(-c6ccc(-n7c(CC)nc8ccccc87)cc6)c5c4)cc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.44
G6PD P11413 1/20 0.41
AOC3 Q16853 1/20 0.39
PIK3CA P42336 2/20 0.38
MEN1 O00255 1/20 0.38
HSP90AA1 P07900 1/20 0.38
KMT2A Q03164 1/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CB P42338 1/20 0.38
MTOR P42345 1/20 0.38
PIK3CG P48736 1/20 0.38
CYP11B2 P19099 1/20 0.37
MDM2 Q00987 1/20 0.37
AOC2 O75106 1/20 0.37
CHEK1 O14757 1/20 0.36
AURKA O14965 1/20 0.36
DAPK3 O43293 1/20 0.36
JAK2 O60674 1/20 0.36
PRKD3 O94806 1/20 0.36
MAP4K4 O95819 1/20 0.36

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
SCHEMBL27000873 0.96 MAPT (0.42) MAPTG6PDAOC3PIK3CAMEN1
SCHEMBL26344545 0.92 MAPT (0.45) MAPTG6PDAOC3MEN1KMT2A
SCHEMBL26344523 0.92 MAPT (0.45) MAPTG6PDAOC3MEN1KMT2A
SCHEMBL26344513 0.91 MAPT (0.44) MAPTG6PDAOC3MEN1KMT2A
SCHEMBL26344498 0.90 MAPT (0.45) MAPTG6PDAOC3MEN1KMT2A
SCHEMBL27000872 0.90 MAPT (0.40) MAPTG6PDMEN1KMT2ACYP11B2
SCHEMBL21392662 0.89 MAPK1 (0.44) MAPTG6PDAOC3PIK3CAMEN1
SCHEMBL26344367 0.88 MAPT (0.42) MAPTPIK3CAMEN1HSP90AA1KMT2A
SCHEMBL26344383 0.88 MAPT (0.42) MAPTPIK3CAMEN1HSP90AA1KMT2A
SCHEMBL24674403 0.88 MEN1 (0.45) MAPTMEN1HSP90AA1KMT2A

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-20190296238-A1 Organic Light-emitting Element LG CHEM, LTD. (KR) 2019-09-26 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-20190296238-A1 Organic Light-emitting Element CRY1, CRY2, NR2E3 MAPT 665/4885G6PD 1438/4885AOC3 168/4885

“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.