SCHEMBL3274723

SCHEMBL3274723

[CH2]c1cccc(B(O)c2cc(F)c(F)c(F)c2)c1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV6 Q9H1D0 3/20 0.35
ORAI1 Q96D31 2/20 0.35
ORAI2 Q96SN7 2/20 0.35
ORAI3 Q9BRQ5 2/20 0.35
PCSK9 Q8NBP7 1/20 0.35
MGLL Q99685 1/20 0.31
ENPP2 Q13822 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
SCHEMBL3275789 0.79 TRPV6 (0.61) TRPV6ORAI1ORAI2ORAI3PCSK9
SCHEMBL13476072 0.79 ACHE (0.41) TRPV6ORAI1ORAI2ORAI3PCSK9
SCHEMBL1804144 0.78 ORAI1 (0.43) TRPV6ORAI1ORAI2ORAI3PCSK9
SCHEMBL14135196 0.75 LPL (0.41) TRPV6ORAI1ORAI2ORAI3PCSK9
SCHEMBL219541 0.72 ENPP2 (0.56) MGLLENPP2
SCHEMBL2407138 0.69 ENPP2 (0.35) TRPV6ORAI1ORAI2ORAI3PCSK9
SCHEMBL3275709 0.68 ORAI1 (0.38) TRPV6ORAI1ORAI2ORAI3PCSK9
SCHEMBL3274666 0.68 ORAI1 (0.38) TRPV6ORAI1ORAI2ORAI3PCSK9
SCHEMBL2090551 0.67 HSD17B1 (0.37)
SCHEMBL2400576 0.66 ENPP2 (0.32) TRPV6ORAI1ORAI2ORAI3ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1961756-B1 NOVEL BISBORON COMPOUND JAPAN SCIENCE & TECH AGENCY (JP) 2016-04-27 EP claimed
US-20100087645-A1 NOVEL BISBORON COMPOUND JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2010-04-08 US claimed
EP-1961756-A1 NOVEL BISBORON COMPOUND Japan Science and Technology Agency (JP) 2008-08-27 EP claimed
EP-1961756-B1 NOVEL BISBORON COMPOUND JAPAN SCIENCE & TECH AGENCY (JP) 2016-04-27 EP disclosed
US-20100087645-A1 NOVEL BISBORON COMPOUND JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2010-04-08 US disclosed
EP-1961756-A1 NOVEL BISBORON COMPOUND Japan Science and Technology Agency (JP) 2008-08-27 EP 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-20100087645-A1 NOVEL BISBORON COMPOUND KCNMB4, CA2, NR0B2 TRPV6 61/4885ORAI1 58/4885ORAI2 414/4885

“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.