SCHEMBL12294233

SCHEMBL12294233

BC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.45
MAPK1 P28482 1/20 0.43
QDPR P09417 1/20 0.31

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
SCHEMBL2491645 0.87 P2RX7 (0.46) P2RX7MAPK1QDPR
SCHEMBL378063 0.87 P2RX7 (0.46) P2RX7MAPK1
SCHEMBL2037752 0.85 P2RX7 (0.45) P2RX7MAPK1
SCHEMBL26204499 0.83 P2RX7 (0.43) P2RX7MAPK1
SCHEMBL22657130 0.83 P2RX7 (0.43) P2RX7MAPK1
SCHEMBL31646251 0.83 P2RX7 (0.43) P2RX7MAPK1
SCHEMBL2640503 0.83 P2RX7 (0.43) P2RX7MAPK1
SCHEMBL19015869 0.83 P2RX7 (0.43) P2RX7MAPK1
SCHEMBL27209158 0.83 MAPK1 (0.44) P2RX7MAPK1
SCHEMBL24104909 0.82 P2RX7 (0.42) P2RX7MAPK1

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
WO-2015057963-A1 FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-23 WO disclosed
US-8012956-B2 Tropane compounds EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-20090163471-A1 Tropane compounds EXELIXIS, INC. 2009-06-25 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-20090163471-A1 Tropane compounds ADRA1B, ADRA2B, ADRB2 P2RX7 1629/4885MAPK1 2739/4885QDPR 784/4885

“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.