SCHEMBL5481998

SCHEMBL5481998

O=C(Oc1ccc(OC(=O)c2ccccc2OCCCCCCCCCBr)cc1)c1ccccc1OCCCCCCCCCBr

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.49
MAPT P10636 4/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KMT2A Q03164 5/20 0.48
MEN1 O00255 2/20 0.48
NR1I2 O75469 1/20 0.48
CHRM2 P08172 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADRA2A P08913 1/20 0.48
OPRK1 P41145 1/20 0.48
HTR2B P41595 1/20 0.48
SLC6A3 Q01959 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
PTGS2 P35354 1/20 0.46
HPGD P15428 2/20 0.46
XBP1 P17861 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 5/20 0.45
ESR1 P03372 1/20 0.45

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
SCHEMBL2457395 0.85 LMNA (0.67) LMNAMAPTL3MBTL1KMT2AMEN1
SCHEMBL10812457 0.83 TSHR (0.54) LMNAMAPTL3MBTL1KMT2AMEN1
SCHEMBL11582311 0.83 LMNA (0.63) LMNAMAPTL3MBTL1KMT2AMEN1
SCHEMBL2169334 0.81 LMNA (0.65) LMNAMAPTL3MBTL1KMT2AMEN1
SCHEMBL27915224 0.81 LMNA (0.65) LMNAMAPTL3MBTL1KMT2AMEN1
SCHEMBL5962507 0.81 LMNA (0.65) LMNAMAPTL3MBTL1KMT2AMEN1
SCHEMBL4395023 0.81 MAPT (0.56) LMNAMAPTL3MBTL1KMT2AMEN1
SCHEMBL24395229 0.80 LMNA (0.69) LMNAMAPTL3MBTL1KMT2AMEN1
SCHEMBL29649457 0.80 LMNA (0.69) LMNAMAPTL3MBTL1KMT2AMEN1
SCHEMBL23970739 0.80 LMNA (0.49) LMNAMAPTL3MBTL1KMT2AMEN1

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-7193087-B2 4-Aminopyridinium compound FUJI PHOTO FILM CO., LTD. (JP) 2007-03-20 US disclosed
US-20050211954-A1 4-Aminopyridinium compound FUJI PHOTO FILM CO., LTD. (JP) 2005-09-29 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-20050211954-A1 4-Aminopyridinium compound CHRM1, PYM1, CHRM4 LMNA 781/4885MAPT 2023/4885L3MBTL1 66/4885

“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.