SCHEMBL3530941

SCHEMBL3530941

CCCCCCc1cc(B(O)OCCO)c(CCCCCC)cc1B(O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 5/20 0.47
ALOX5 P09917 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
TSHR P16473 2/20 0.40
CYP3A4 P08684 2/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
TYR P14679 1/20 0.40
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LPL P06858 4/20 0.37
TRPV1 Q8NER1 1/20 0.37
MGLL Q99685 1/20 0.37
CNR2 P34972 4/20 0.37
ALDH1A1 P00352 2/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL7031877 0.82 LIPG (0.66) LIPGALOX5MEN1KMT2ATSHR
SCHEMBL17044883 0.82 LIPG (0.66) LIPGALOX5MEN1KMT2ATSHR
SCHEMBL560421 0.82 LIPG (0.66) LIPGALOX5MEN1KMT2ATSHR
SCHEMBL3534197 0.77 MEN1 (0.39) LIPGMEN1KMT2ACYP3A4MAPT
SCHEMBL4270833 0.73 LIPG (0.41) LIPGALOX5MEN1KMT2ATSHR
SCHEMBL9470255 0.73 LIPG (0.54) LIPGALOX5MEN1KMT2ATSHR
SCHEMBL31274542 0.73 LIPG (0.54) LIPGALOX5MEN1KMT2ATSHR
SCHEMBL10027415 0.71 LIPG (0.47) LIPGALOX5MEN1KMT2ATSHR
SCHEMBL28477703 0.66 LIPG (0.53) LIPGALOX5MEN1KMT2ATSHR
SCHEMBL14151092 0.66 LMNA (0.59) LIPGALOX5MEN1KMT2ATSHR

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-7714099-B2 Luminescent compositions and their uses HITACHI CHEMICAL CO., LTD. (JP) 2010-05-11 US disclosed
WO-2006041221-A1 NEW LUMINESCENT COMPOSITIONS AND THEIR USES HITACHI CHEMICAL CO., LTD. (JP) 2006-04-20 WO disclosed
US-20060083945-A1 New luminescent compositions and their uses HITACHI CHEMICAL CO. LTD. (JP) 2006-04-20 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-20060083945-A1 New luminescent compositions and their uses OCIAD1, NLRP3, OCIAD2 LIPG 2230/4885ALOX5 845/4885MEN1 4288/4885

“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.