SCHEMBL2352991

SCHEMBL2352991

Cc1ccc(B(O)OC(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.48
LPL P06858 1/20 0.48
LIPG Q9Y5X9 1/20 0.48
ORAI1 Q96D31 1/20 0.48
ORAI2 Q96SN7 1/20 0.48
ORAI3 Q9BRQ5 1/20 0.48
TRPV6 Q9H1D0 1/20 0.48
ALDH1A1 P00352 6/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 4/20 0.38
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
SRD5A2 P31213 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
CTBP2 P56545 1/20 0.35
HTT P42858 3/20 0.34
NPSR1 Q6W5P4 3/20 0.34
KMT2A Q03164 3/20 0.34
PKM P14618 2/20 0.34

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
SCHEMBL1672441 0.80 ORAI1 (0.46) CA2ORAI1ORAI2ORAI3TRPV6
SCHEMBL14645353 0.80 CA1 (0.55) CA2SMN1; SMN2CES2CES1CTBP2
SCHEMBL3793010 0.79 KDM4E (0.35) ALDH1A1LMNATDP1KMT2APKM
SCHEMBL3470948 0.79 TSHR (0.50) CA2ALDH1A1SMN1; SMN2CES2CES1
SCHEMBL5276490 0.79 LPL (0.53) CA2LPLLIPGALDH1A1SMN1; SMN2
SCHEMBL18980769 0.77 LMNA (0.41) SMN1; SMN2LMNAKMT2AMEN1GAA
SCHEMBL5700030 0.77 USP2 (0.49) CA2LPLLIPGORAI1ORAI2
SCHEMBL5586183 0.75 ORAI1 (0.67) CA2LPLLIPGORAI1ORAI2
SCHEMBL14282970 0.73 CA2 (0.56) CA2LPLLIPGORAI1ORAI2
SCHEMBL3918805 0.71 CA2 (0.54) CA2LPLLIPGORAI1ORAI2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105802612-A Synthesis method of ratiometric fluorescent probe for detecting oxygen content in living cells 济南大学 2016-07-27 CN claimed
CN-105802612-A Synthesis method of ratiometric fluorescent probe for detecting oxygen content in living cells 济南大学 2016-07-27 CN disclosed
US-8921309-B2 Lipopeptide compounds and their use UNIQUEST PTY LIMITED (AU) 2014-12-30 US disclosed
EP-2350119-B1 LIPOPEPTIDE COMPOUNDS AND THEIR USE UNIQUEST PTY LTD (AU) 2014-10-29 EP disclosed
US-20110224129-A1 Lipopeptide Compounds and Their Use MERLION PHARMACEUTICALS PTE LTD (SG) 2011-09-15 US disclosed
EP-2350119-A1 LIPOPEPTIDE COMPOUNDS AND THEIR USE Merlion Pharmaceuticals Pte Ltd. (SG) 2011-08-03 EP disclosed
WO-2010062264-A1 LIPOPEPTIDE COMPOUNDS AND THEIR USE MERLION PHARMACEUTICALS PTE LTD (SG) 2010-06-03 WO 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-20110224129-A1 Lipopeptide Compounds and Their Use VIP, LTA, CLPTM1 CA2 4691/4885LPL 20/4885LIPG 55/4885

“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.