SCHEMBL3346080

SCHEMBL3346080

NC(=O)c1cc(-n2ncc(=O)[nH]c2=O)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 11/20 0.47
ABCB11 O95342 1/20 0.46
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 1/20 0.40
NR1I2 O75469 1/20 0.40
KMT2A Q03164 1/20 0.40
THRB P10828 6/20 0.37
THRA P10827 3/20 0.37
RIPK2 O43353 1/20 0.37

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
SCHEMBL3348732 0.84 P2RX7 (0.58) P2RX7ABCB11LMNARAB9ASMN1; SMN2
SCHEMBL3346085 0.81 MEN1 (0.43) P2RX7ABCB11MEN1NR1I2KMT2A
SCHEMBL6168543 0.77 PARP1 (0.46) P2RX7ABCB11MEN1NR1I2KMT2A
SCHEMBL1412866 0.75 P2RX7 (0.64) P2RX7ABCB11MEN1NR1I2KMT2A
SCHEMBL1412972 0.75 P2RX7 (0.65) P2RX7ABCB11MEN1NR1I2KMT2A
SCHEMBL1412845 0.75 P2RX7 (0.59) P2RX7ABCB11MEN1NR1I2KMT2A
SCHEMBL30174384 0.74 THRB (0.46) P2RX7LMNARAB9ASMN1; SMN2MEN1
SCHEMBL6247451 0.73 P2RX7 (0.80) P2RX7ABCB11
SCHEMBL3346868 0.73 CA12 (0.47) P2RX7LMNARAB9ASMN1; SMN2RIPK2
SCHEMBL7253392 0.73 P2RX7 (0.49) P2RX7ABCB11MEN1NR1I2KMT2A

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 P2RX7 8/4885ABCB11 1044/4885LMNA 2330/4885

“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.