SCHEMBL3239193

SCHEMBL3239193

COc1ccc(C2(c3cccc(OCCCF)c3)NC(N)c3ncccc32)cc1C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.35
CTSD P07339 1/20 0.35
BACE2 Q9Y5Z0 1/20 0.35
P2RX7 Q99572 2/20 0.32
SYK P43405 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
SCHEMBL3243721 0.88 GCK (0.33) BACE1CTSDBACE2
SCHEMBL3243768 0.84 BACE1 (0.33) BACE1
SCHEMBL3239146 0.84 P2RX7 (0.34) BACE1P2RX7
SCHEMBL3245129 0.83 KDM1A (0.31)
SCHEMBL3240569 0.82 BACE1 (0.32) BACE1P2RX7
SCHEMBL3245524 0.82 HCAR2 (0.31) BACE1
SCHEMBL3239191 0.78 BACE1 (0.42) BACE1CTSDBACE2
SCHEMBL3242727 0.77 BACE1 (0.37) BACE1
SCHEMBL3249132 0.76 KDM1A (0.38) BACE1CTSDP2RX7SYK
SCHEMBL3244330 0.75 BACE1 (0.35) BACE1

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
WO-2010056195-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 WO claimed
US-20100125087-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 US claimed
WO-2010056195-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 WO disclosed
US-20100125087-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 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-20100125087-A1 NEW COMPOUNDS 575 PSEN1, PSEN2, BACE1 BACE1 3/4885CTSD 620/4885BACE2 12/4885

“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.