SCHEMBL807982

SCHEMBL807982

Nc1nc2ccc(-c3ccc4ncc5nnc(-c6ccc(F)cn6)n5c4c3)cc2s1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.45
PIK3CA P42336 16/20 0.45
PI4KA P42356 15/20 0.45
PI4KB Q9UBF8 15/20 0.45
PIK3CD O00329 14/20 0.45
PIK3CG P48736 13/20 0.45
PIK3CB P42338 11/20 0.45
AXL P30530 1/20 0.43
GFER P55789 1/20 0.43
PIP5K1C O60331 5/20 0.42
ALKBH5 Q6P6C2 1/20 0.41
FTO Q9C0B1 1/20 0.41
AKT1 P31749 1/20 0.40
MTOR P42345 1/20 0.40

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
SCHEMBL10070633 0.90 PI4KA (0.46) PIK3CAPI4KAPI4KBPIK3CDPIK3CG
SCHEMBL15131809 0.87 PIK3CA (0.43) PIK3CAPI4KAPI4KBPIK3CDPIK3CG
SCHEMBL15131802 0.80 PRKDC (0.48) PIK3CBMTOR
SCHEMBL807985 0.79 PIK3CA (0.45) PIK3CAPI4KAPI4KBPIK3CDPIK3CG
SCHEMBL807819 0.78 PIK3CA (0.43) PIK3CAPI4KBPIK3CDPIK3CGPIK3CB
SCHEMBL807817 0.78 PI4KA (0.52) PIK3CAPI4KAPI4KBPIK3CDPIK3CG
SCHEMBL807826 0.76 PI4KA (0.45) PIK3CAPI4KAPI4KBPIK3CDPIK3CG
SCHEMBL15131799 0.74 PI4KA (0.48) PIK3CAPI4KAPI4KBPIK3CDPIK3CG
SCHEMBL15131807 0.70 PRKDC (0.52) PIK3CBMTOR
SCHEMBL10070628 0.67 PIK3CA (0.46) PIK3CAPI4KBPIK3CDPIK3CGPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181264-B2 Fused heteroaryls and their uses HUTCHISON MEDIPHARMA LIMITED (CN) 2015-11-10 US disclosed
US-9181264-B2 Fused heteroaryls and their uses HUTCHISON MEDIPHARMA LIMITED (CN) 2015-11-10 US disclosed
US-20130190307-A1 FUSED HETEROARYLS AND THEIR USES HUTCHISON MEDIPHARMA LIMITED (CN) 2013-07-25 US disclosed
US-20130190307-A1 FUSED HETEROARYLS AND THEIR USES HUTCHISON MEDIPHARMA LIMITED (CN) 2013-07-25 US disclosed
WO-2012034526-A1 FUSED HETEROARYLS AND THEIR USES HUTCHISON MEDIPHARMA LIMITED (CN) 2012-03-22 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-20130190307-A1 FUSED HETEROARYLS AND THEIR USES FARS2, TIAL1, DHFR MET 1020/4885PIK3CA 1962/4885PI4KA 2058/4885

“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.