SCHEMBL205109

SCHEMBL205109

Brc1ccc2c(c1)ncc1nc3n(c12)CCCO3

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 6/20 0.39
KMT2A Q03164 1/20 0.36
PIK3CD O00329 2/20 0.35
PIK3CB P42338 2/20 0.35
PIK3CG P48736 2/20 0.35
ACHE P22303 1/20 0.33
PTGES O14684 7/20 0.33
EGFR P00533 2/20 0.32
ERBB2 P04626 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
PREP P48147 1/20 0.31

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
SCHEMBL202167 0.78 PIK3CA (0.38) PIK3CAKMT2APIK3CDPIK3CBPIK3CG
SCHEMBL23042465 0.77 PIK3CA (0.40) PIK3CAKMT2APIK3CDPIK3CBPIK3CG
SCHEMBL203370 0.77 MAOB (0.41) KMT2A
SCHEMBL15834998 0.74 KMT2A (0.53) PIK3CAKMT2APIK3CDPIK3CBPIK3CG
SCHEMBL4520769 0.71 POLB (0.36) KMT2AACHEPTGESPREP
SCHEMBL205088 0.66 BACE1 (0.34) PIK3CD
SCHEMBL1233797 0.65 CYP8B1 (0.38) KMT2APREP
SCHEMBL17474597 0.64 KMT2A (0.65) PIK3CAKMT2APIK3CDPIK3CBPIK3CG
SCHEMBL1773941 0.64 LRRK2 (0.37) PTGES
SCHEMBL24329889 0.63 KMT2A (0.39) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088788-B2 Substituted fused[1,2] imidazo[4,5-c] ring compounds and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-01-03 US disclosed
US-20090221551-A1 SUBSTITUTED FUSED[1,2] IMIDAZO[4,5C] RING COMPOUNDS AND METHODS PFIZER INC. 2009-09-03 US disclosed
WO-2007106852-A2 SUBSTITUTED FUSED[1,2]IMIDAZO[4,5-C] RING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-09-20 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-20090221551-A1 SUBSTITUTED FUSED[1,2] IMIDAZO[4,5C] RING COMPOUNDS AND METHODS IL2, IFNG, IL4 PIK3CA 1007/4885KMT2A 3293/4885PIK3CD 1065/4885

“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.