SCHEMBL5368058

SCHEMBL5368058

COC(=O)CCCCCNC(=O)COc1ccc(S(=O)(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.52
MAPT P10636 6/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
MAPK1 P28482 2/20 0.51
CASP6 P55212 1/20 0.50
LMNA P02545 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
PKM P14618 1/20 0.48
ALDH1A1 P00352 5/20 0.47
POLB P06746 1/20 0.43
HDAC1 Q13547 1/20 0.43

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
SCHEMBL5359783 0.90 MAPT (0.49) SMN1; SMN2MAPTMEN1KMT2ANPC1
SCHEMBL5368271 0.86 MAPK1 (0.53) SMN1; SMN2MAPTKMT2AMAPK1LMNA
SCHEMBL5368110 0.80 MAPT (0.57) SMN1; SMN2MAPTMEN1KMT2ANPC1
SCHEMBL5367210 0.77 MAPK1 (0.72) SMN1; SMN2MAPTMEN1KMT2ANPC1
SCHEMBL21708265 0.76 MAPT (0.62) SMN1; SMN2MAPTMEN1KMT2ANPC1
SCHEMBL5360419 0.76 SMN1; SMN2 (0.50) SMN1; SMN2MEN1KMT2ATDP1PKM
SCHEMBL5370473 0.75 ALDH1A1 (0.43) SMN1; SMN2MAPTKMT2AMAPK1PKM
SCHEMBL17934215 0.74 MAPT (0.62) SMN1; SMN2MAPTMEN1KMT2ANPC1
SCHEMBL5362108 0.74 KMT2A (0.54) SMN1; SMN2MAPTMEN1KMT2ANPC1
SCHEMBL8752415 0.73 MAPT (0.65) SMN1; SMN2MAPTMEN1KMT2ANPC1

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-7294716-B2 Process for preparing isomerically pure prodrugs of proton pump inhibitors ALLERGAN, INC. (US) 2007-11-13 US disclosed
US-20050038076-A1 Process for preparing isomerically pure prodrugs of proton pump inhibitors ALEVIUM PHARMACEUTICALS, INC. 2005-02-17 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-20050038076-A1 Process for preparing isomerically pure prodrugs of proton pump inhibitors SI, ATP6AP1, HRH2 SMN1; SMN2 2675/4885MAPT 4649/4885MEN1 2438/4885

“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.