SCHEMBL21787203

SCHEMBL21787203

CCc1cc(B(O)O)cc(B(O)O)c1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPL P06858 9/20 0.58
LIPG Q9Y5X9 9/20 0.58
ENPP2 Q13822 3/20 0.41
CA2 P00918 2/20 0.40
CA1 P00915 1/20 0.40
TRPV1 Q8NER1 1/20 0.38
MGLL Q99685 1/20 0.38
TRPA1 O75762 1/20 0.36
F11 P03951 1/20 0.34
PTGS2 P35354 1/20 0.34
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
HSPA5 P11021 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
SCHEMBL3791528 0.95 LPL (0.58) LPLLIPGENPP2CA2CA1
SCHEMBL3784543 0.86 LPL (0.50) LPLLIPGENPP2CA2CA1
SCHEMBL3786679 0.84 LPL (0.48) LPLLIPGENPP2CA2CA1
SCHEMBL10136924 0.84 LPL (0.49) LPLLIPGENPP2CA2CA1
SCHEMBL10269834 0.84 LPL (0.48) LPLLIPGENPP2CA2CA1
SCHEMBL12247400 0.84 LPL (0.48) LPLLIPGENPP2CA2CA1
SCHEMBL23958100 0.81 LPL (0.45) LPLLIPGENPP2CA2CA1
SCHEMBL14665438 0.81 ENPP2 (0.48) LPLLIPGENPP2CA2CA1
SCHEMBL12327391 0.80 ENPP2 (0.47) LPLLIPGENPP2CA2CA1
SCHEMBL17677146 0.80 MGLL (0.47) LPLLIPGENPP2MGLL

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
US-20220119780-A1 ENGINEERED PYROCOCCUS ENZYMES AND USES THEREOF FIRST-CITIZENS BANK & TRUST COMPANY 2022-04-21 US disclosed
US-11136565-B2 Modified archaeal family B polymerases Singular Genomics Systems, Inc. (US) 2021-10-05 US disclosed
US-20200069717-A1 NUCLEOTIDE DERIVATIVES AND METHODS OF USE THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2020-03-05 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-20200069717-A1 NUCLEOTIDE DERIVATIVES AND METHODS OF USE THEREOF POLRMT, NSUN2, RNGTT LPL 2816/4885LIPG 3273/4885ENPP2 1916/4885

“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.