SCHEMBL4124643

SCHEMBL4124643

CCCCOCCOCC(=O)NC(C)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.53
ALDH1A1 P00352 4/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
GAA P10253 2/20 0.53
HPGD P15428 1/20 0.53
LMNA P02545 2/20 0.51
USP2 O75604 1/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
PARP1 P09874 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TSHR P16473 1/20 0.49
RECQL P46063 1/20 0.49

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
SCHEMBL4124642 1.00 POLB (0.53) POLBALDH1A1KMT2AMEN1GAA
SCHEMBL4127562 0.92 POLB (0.53) POLBALDH1A1KMT2AMEN1GAA
SCHEMBL4127567 0.92 POLB (0.53) POLBALDH1A1KMT2AMEN1GAA
SCHEMBL13772497 0.86 MEN1 (0.54) POLBALDH1A1KMT2AMEN1GAA
SCHEMBL4132997 0.83 ALDH1A1 (0.55) POLBALDH1A1KMT2AGAAHPGD
SCHEMBL4132995 0.83 ALDH1A1 (0.55) POLBALDH1A1KMT2AGAAHPGD
SCHEMBL23743176 0.78 MEN1 (0.50) KMT2AMEN1GAALMNAMAPT
SCHEMBL9317172 0.77 POLB (0.58) POLBALDH1A1KMT2AMEN1GAA
SCHEMBL327206 0.76 SMN1; SMN2 (0.57) POLBALDH1A1LMNARAB9ASMN1; SMN2
SCHEMBL13865117 0.76 MAPT (0.52) POLBALDH1A1KMT2AMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA TOUCH BIONICS LIMITED (GB) 2009-07-30 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-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA PGLS, TFPI, Q6ZSR9 POLB 1144/4885ALDH1A1 4657/4885KMT2A 3636/4885

“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.