SCHEMBL7126590

SCHEMBL7126590

Cc1ncc(-c2cccc(Nc3ncnc4c3CCc3ccsc3-4)c2)n1C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 4/20 0.43
LMNA P02545 2/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
EGFR P00533 6/20 0.35
MKNK1 Q9BUB5 2/20 0.34
RIPK3 Q9Y572 1/20 0.33
PIK3CD O00329 1/20 0.33
KDM4E B2RXH2 1/20 0.33
F9 P00740 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
TTK P33981 1/20 0.32
IGF1R P08069 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
SCHEMBL7127426 0.86 RIPK2 (0.44) RIPK2LMNAHPGDHTTEGFR
SCHEMBL7126117 0.84 RIPK2 (0.41) RIPK2LMNAEGFRMKNK1PIK3CD
SCHEMBL7119176 0.81 RIPK2 (0.39) RIPK2LMNAHPGDHTTEGFR
SCHEMBL7125172 0.80 EGFR (0.39) RIPK2LMNAHPGDEGFRMKNK1
SCHEMBL7120220 0.76 EGFR (0.41) RIPK2EGFRTTK
SCHEMBL7118837 0.73 DYRK1A (0.38) RIPK2EGFRMKNK1TTKIGF1R
SCHEMBL7115986 0.73 DYRK1A (0.38) RIPK2HPGDMKNK1TTK
SCHEMBL7129801 0.70 RIPK2 (0.48) RIPK2LMNAHPGDHTTEGFR
SCHEMBL7125990 0.69 CYP1A2 (0.36) RIPK2MKNK1TTK
SCHEMBL7118472 0.68 EGFR (0.55) RIPK2LMNAHTTEGFR

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-20030176454-A1 N-coating heterocyclic compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-09-18 US disclosed
WO-2001087845-A2 N-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE AS 5-HT ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-11-22 WO 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-20030176454-A1 N-coating heterocyclic compounds H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, GNE, NIT2 RIPK2 3457/4885LMNA 1315/4885HPGD 328/4885

“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.