SCHEMBL4223255

SCHEMBL4223255

COc1cc(CCO)c([N+](=O)[O-])c(OC)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.56
CHEK1 O14757 3/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MCL1 Q07820 1/20 0.40
HTT P42858 3/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 2/20 0.40
KDM4E B2RXH2 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PTGS2 P35354 1/20 0.38
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 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
SCHEMBL8073542 0.88 PKM (0.59) PKMLMNASMN1; SMN2MCL1HTT
SCHEMBL18138448 0.83 PKM (0.56) PKMLMNASMN1; SMN2MCL1HTT
SCHEMBL4222267 0.81 PKM (0.55) PKMLMNASMN1; SMN2MCL1HTT
SCHEMBL13778225 0.81 PKM (0.55) PKMLMNASMN1; SMN2MCL1HTT
SCHEMBL9820284 0.81 TDP1 (0.41) PKMCHEK1SMN1; SMN2HTTALDH1A1
Bromide SCHEMBL4217783 0.80 PKM (0.54) PKMLMNASMN1; SMN2MCL1HTT
SCHEMBL9681717 0.79 PKM (0.52) PKMLMNASMN1; SMN2MCL1HTT
SCHEMBL9348700 0.77 PKM (0.65) PKMLMNASMN1; SMN2MCL1HTT
SCHEMBL6573968 0.76 RAB9A (0.55) CHEK1LMNASMN1; SMN2HTTALDH1A1
SCHEMBL2905398 0.76 PKM (0.59) PKMLMNASMN1; SMN2MCL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7560491-B2 Z-stilbenes derivatives and the pharmaceutical composition thereof TAIPEI MEDICAL UNIVERSITY (TW) 2009-07-14 US disclosed
US-20080096973-A1 Z-stilbenes derivatives and the pharmaceutical composition thereof TAIPEI MEDICAL UNIVERSITY (TW) 2008-04-24 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-20080096973-A1 Z-stilbenes derivatives and the pharmaceutical composition thereof CCNB1, ZYX, H1-0 PKM 2125/4885CHEK1 482/4885LMNA 1710/4885

“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.