SCHEMBL25124503

SCHEMBL25124503

CC(C)Nc1ccn2ncnc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 2/20 0.46
PIK3CD O00329 1/20 0.36
ERBB2 P04626 1/20 0.36
TGFBR1 P36897 2/20 0.35
NTRK1 P04629 1/20 0.35
AXL P30530 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
EGFR P00533 2/20 0.33
KDR P35968 2/20 0.33
FLT1 P17948 1/20 0.33
FLT4 P35916 1/20 0.33
MAPK1 P28482 1/20 0.33
AAK1 Q2M2I8 3/20 0.33
PIK3CA P42336 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL21646380 0.81 MAP4K4 (0.42) MAP4K4PIK3CDTGFBR1NTRK1EGFR
SCHEMBL27154054 0.78 ERBB2 (0.51) ERBB2EGFR
SCHEMBL25124483 0.77 EGLN2 (0.45) MAP4K4PIK3CDERBB2TGFBR1NTRK1
SCHEMBL21646347 0.75 MAP4K4 (0.44) MAP4K4PIK3CDTGFBR1AXLTDP1
SCHEMBL902674 0.74 TGFBR1 (0.37) MAP4K4PIK3CDTGFBR1NTRK1MAPK1
SCHEMBL22122747 0.72 AURKB (0.38) PIK3CDNTRK1EGFRKDRFLT1
SCHEMBL23691885 0.72 TGFBR1 (0.34) MAP4K4PIK3CDTGFBR1NTRK1MAPK1
SCHEMBL23055259 0.71 IRAK4 (0.43) MAP4K4PIK3CDNTRK1TDP1LMNA
SCHEMBL23055242 0.71 PIK3CD (0.38) MAP4K4PIK3CDNTRK1TDP1EGFR
SCHEMBL25335507 0.71 MAPK1 (0.36) MAP4K4PIK3CDTGFBR1NTRK1EGFR

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-20230109839-A1 THERAPEUTIC AGENT FOR TAUOPATHIES Sumitomo Pharma Co., Ltd. (JP) 2023-04-13 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-20230109839-A1 THERAPEUTIC AGENT FOR TAUOPATHIES MAPT, PSEN1, PSEN2 MAP4K4 902/4885PIK3CD 3545/4885ERBB2 4669/4885

“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.