SCHEMBL2007804

SCHEMBL2007804

[NH]C(=O)c1ccc2oncc2c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.45
NAMPT P43490 1/20 0.34
TRPM5 Q9NZQ8 1/20 0.33
HDAC6 Q9UBN7 6/20 0.33
SYK P43405 2/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CTNNB1 P35222 1/20 0.30
WNT3A P56704 1/20 0.30
HDAC3 O15379 2/20 0.30
HDAC1 Q13547 2/20 0.30
HDAC2 Q92769 2/20 0.30
HDAC8 Q9BY41 2/20 0.30
PLAU P00749 1/20 0.30

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
SCHEMBL2010478 0.86 CHRNA7 (0.34) CHRNA7HDAC6NPC1RAB9AMEN1
SCHEMBL15660345 0.84 CHRNA7 (0.49) CHRNA7NPC1RAB9A
SCHEMBL31605591 0.82 LCK (0.46) CHRNA7SYKPLAU
SCHEMBL31605579 0.82 CHRNA7 (0.45) CHRNA7NAMPTTRPM5HDAC6SYK
SCHEMBL2007808 0.82 LCK (0.46) CHRNA7SYKPLAU
SCHEMBL31605605 0.78 RAB9A (0.48) CHRNA7RAB9AHDAC1
SCHEMBL28348940 0.77 CHRNA7 (0.42) CHRNA7NAMPTTRPM5MEN1KMT2A
SCHEMBL10592495 0.71 CHRNA7 (0.33) CHRNA7SYK
SCHEMBL2001766 0.71 TRPM5 (0.37) CHRNA7TRPM5SYK
SCHEMBL1359012 0.71 CA12 (0.42) TRPM5

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-7960394-B2 3,8-dimethyl-2-[4-(3-piperidin-1-ylpropoxy)phenyl]-4(3H)-quinazolinone; 6-chloro-3-methyl-2-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrido[3,4-d]-pyrimidin-4(3H)-one; 2-[4-(1-cyclopentyl-4-piperidinyloxy)phenyl]-3-methylpyrido[2,3-d]-pyrimidin-4(3H)-one; treats metabolic, nervous system, vascular disorders BANYU PHARMACEUTICAL CO., LTD. (JP) 2011-06-14 US disclosed
US-20080275069-A1 Quinazoline Derivative MSD K.K. (JP) 2008-11-06 US disclosed
EP-1757594-A1 QUINAZOLINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-02-28 EP 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-20080275069-A1 Quinazoline Derivative HRH3, HRH4, HRH2 CHRNA7 110/4885NAMPT 4329/4885TRPM5 314/4885

“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.