SCHEMBL3346085

SCHEMBL3346085

Nc1cc(-n2ncc(=O)[nH]c2=O)ccc1F

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
NR1I2 O75469 1/20 0.43
KMT2A Q03164 1/20 0.43
P2RX7 Q99572 11/20 0.41
ABCB11 O95342 1/20 0.39
THRB P10828 6/20 0.39
THRA P10827 4/20 0.37
GRIA1 P42261 1/20 0.35
GRIA2 P42262 1/20 0.35
GRIA4 P48058 1/20 0.35
GRIK5 Q16478 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
SCHEMBL3348736 0.82 P2RX7 (0.48) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL3346080 0.81 P2RX7 (0.47) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL30174384 0.78 THRB (0.46) MEN1NR1I2KMT2AP2RX7THRB
SCHEMBL3582300 0.76 TSHR (0.42) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL10439328 0.76 MAPK14 (0.45) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL7909905 0.74 KMT2A (0.58) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL7919792 0.73 MEN1 (0.56) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL30174385 0.71 MEN1 (0.47) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL10512600 0.71 HIF1A (0.50) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL6242523 0.71 CNOT7 (0.51) MEN1NR1I2KMT2AP2RX7ABCB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160384-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 US 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-20100160384-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX6, P2RX3 MEN1 2632/4885NR1I2 391/4885KMT2A 3250/4885

“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.