SCHEMBL7127529

SCHEMBL7127529

Cc1ncc(-c2cccc(Nc3ncnc4c(-c5ccsc5)cccc34)c2)n1C

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 3/20 0.46
EGFR P00533 7/20 0.37
LMNA P02545 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HTT P42858 2/20 0.36
HPGD P15428 1/20 0.36
TTK P33981 1/20 0.36
FYN P06241 2/20 0.35
HIF1A Q16665 1/20 0.35
TP53 P04637 1/20 0.35
CTSL P07711 1/20 0.35
CTSC P53634 1/20 0.35

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
SCHEMBL7119935 0.87 RIPK2 (0.41) RIPK2TTKFYNCTSLCTSC
SCHEMBL7129801 0.85 RIPK2 (0.48) RIPK2EGFRLMNAKDM4EHTT
SCHEMBL7128686 0.80 RIPK2 (0.47) RIPK2EGFRLMNAKDM4EHTT
SCHEMBL7126625 0.78 EGFR (0.37) EGFRLMNAKDM4EHTTHPGD
SCHEMBL7124267 0.73 DYRK1A (0.46) LMNAKDM4EHTTFYNTP53
SCHEMBL7125034 0.71 RIPK2 (0.42) RIPK2LMNAKDM4EHPGDTTK
SCHEMBL7118472 0.70 EGFR (0.55) RIPK2EGFRLMNAHTTTP53
SCHEMBL7127426 0.70 RIPK2 (0.44) RIPK2EGFRLMNAKDM4EHTT
SCHEMBL7121293 0.70 FYN (0.40) FYN
SCHEMBL7121297 0.70 FYN (0.40) FYN

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 3457/4885EGFR 319/4885LMNA 1315/4885

“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.