SCHEMBL5814820

SCHEMBL5814820

Fc1c(F)c(-c2nnnn2Cc2ccccc2)c(F)c(F)c1Br

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 8/20 0.54
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.46
HDAC6 Q9UBN7 1/20 0.45
GRM2 Q14416 2/20 0.42
SLC9A1 P19634 1/20 0.42
POLB P06746 1/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL5824231 0.79 P2RX7 (0.63) P2RX7KMT2AALDH1A1GRM2
SCHEMBL5815309 0.76 P2RX7 (0.71) P2RX7KMT2AALDH1A1LMNAHTT
SCHEMBL4403732 0.75 P2RX7 (0.81) P2RX7KMT2AALDH1A1LMNAHDAC6
SCHEMBL6362505 0.75 P2RX7 (0.70) P2RX7KMT2AALDH1A1LMNAHDAC6
SCHEMBL6357793 0.75 P2RX7 (0.70) P2RX7KMT2AALDH1A1LMNAHDAC6
SCHEMBL5813523 0.75 P2RX7 (0.65) P2RX7KMT2AALDH1A1LMNAHDAC6
SCHEMBL5917600 0.74 P2RX7 (0.64) P2RX7KMT2AALDH1A1LMNA
SCHEMBL5815339 0.74 P2RX7 (0.57) P2RX7KMT2AALDH1A1LMNAHDAC6
SCHEMBL994214 0.73 LMNA (0.57) P2RX7KMT2AALDH1A1LMNAGRM2
SCHEMBL950306 0.73 LMNA (0.57) P2RX7KMT2AALDH1A1LMNAHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060211739-A1 Use of selective P2X7 receptor antagonists ABBOTT LABORATORIES 2006-09-21 US claimed
WO-2006086229-A1 THE USE OF SELECTIVE P2X7 RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 2006-08-17 WO claimed
US-20060211739-A1 Use of selective P2X7 receptor antagonists ABBOTT LABORATORIES 2006-09-21 US disclosed
WO-2006086229-A1 THE USE OF SELECTIVE P2X7 RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 2006-08-17 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-20060211739-A1 Use of selective P2X7 receptor antagonists P2RX1, P2RX3, P2RX7 P2RX7 3/4885KMT2A 3534/4885ALDH1A1 810/4885

“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.