SCHEMBL2408018

SCHEMBL2408018

OB(c1ccccc1)c1ccccc1CCOC(B(O)c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PCSK9 Q8NBP7 1/20 0.34
ORAI1 Q96D31 1/20 0.34
ORAI2 Q96SN7 1/20 0.34
ORAI3 Q9BRQ5 1/20 0.34
TRPV6 Q9H1D0 1/20 0.34
LIPG Q9Y5X9 1/20 0.32

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
SCHEMBL2408016 0.74 TRPV6 (0.41) PCSK9ORAI1ORAI2ORAI3TRPV6
SCHEMBL341836 0.70 TAAR1 (0.47) PCSK9ORAI1ORAI2ORAI3TRPV6
SCHEMBL2400587 0.69 ORAI1 (0.42) PCSK9ORAI1ORAI2ORAI3TRPV6
SCHEMBL2400530 0.68 TRPV6 (0.48) PCSK9ORAI1ORAI2ORAI3TRPV6
Methyl Alcohol SCHEMBL27541809 0.67 TAAR1 (0.44) PCSK9ORAI1ORAI2ORAI3TRPV6
SCHEMBL1469675 0.66 TRPV6 (0.50) PCSK9ORAI1ORAI2ORAI3TRPV6
SCHEMBL3274578 0.66 TRPV6 (0.50) PCSK9ORAI1ORAI2ORAI3TRPV6
SCHEMBL12271157 0.66 TRPV6 (0.50) PCSK9ORAI1ORAI2ORAI3TRPV6
SCHEMBL2405995 0.65 ORAI1 (0.38) PCSK9ORAI1ORAI2ORAI3TRPV6
SCHEMBL2405808 0.64 TRPV6 (0.72) PCSK9ORAI1ORAI2ORAI3TRPV6

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
EP-1961756-B1 NOVEL BISBORON COMPOUND JAPAN SCIENCE & TECH AGENCY (JP) 2016-04-27 EP claimed
US-8853424-B2 Protein cross-linking inhibitor JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2014-10-07 US disclosed
US-20110212919-A1 PROTEIN CROSS-LINKING INHIBITOR JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-09-01 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-20110212919-A1 PROTEIN CROSS-LINKING INHIBITOR BAZ2B, PRMT1, BRIX1 PCSK9 2110/4885ORAI1 4605/4885ORAI2 3906/4885

“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.