SCHEMBL796725

SCHEMBL796725

Nc1ncc(-c2ccc3ncc4nnn(C5CCN(CC6CCOCC6)CC5)c4c3n2)cc1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAP3K12 Q12852 13/20 0.40
MAP3K13 O43283 1/20 0.40
NTRK1 P04629 1/20 0.40
CSF1R P07333 1/20 0.40
AXL P30530 1/20 0.40
FLT3 P36888 1/20 0.40
MAP3K9 P80192 1/20 0.40
MAP3K10 Q02779 1/20 0.40
DMPK Q09013 1/20 0.40
EPHA7 Q15375 1/20 0.40
MTOR P42345 4/20 0.39
PIK3CA P42336 4/20 0.39
MAP4K4 O95819 1/20 0.38
DYRK1A Q13627 1/20 0.36

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
SCHEMBL807979 0.95 MAP3K12 (0.40) MAP3K12MAP3K13NTRK1CSF1RAXL
SCHEMBL15133595 0.91 MAP3K12 (0.45) MAP3K12MTORPIK3CA
SCHEMBL15131793 0.88 PIK3CA (0.41) MTORPIK3CAMAP4K4DYRK1A
SCHEMBL807978 0.87 MTOR (0.46) MAP3K12MTORPIK3CA
SCHEMBL10070700 0.86 MTOR (0.46) MAP3K12MTORPIK3CAMAP4K4
SCHEMBL808106 0.85 MTOR (0.39) MAP3K12MTORPIK3CA
SCHEMBL10070651 0.85 MAP3K12 (0.46) MAP3K12MTORPIK3CAMAP4K4
SCHEMBL10070701 0.83 MTOR (0.41) MAP3K12MTORPIK3CAMAP4K4
SCHEMBL15131770 0.82 PIK3CA (0.40) MTORPIK3CADYRK1A
SCHEMBL15131778 0.82 PIK3CA (0.45) MAP3K12MTORPIK3CA

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 6 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
EP-2616468-A1 FUSED HETEROARYLS AND THEIR USES Hutchison Medipharma Limited (CN) 2013-07-24 EP 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 MAP3K12 4755/4885MAP3K13 4682/4885NTRK1 864/4885

“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.