SCHEMBL6709526

SCHEMBL6709526

COC(=O)c1ccc(OCc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.74
NPC1 O15118 3/20 0.66
RAB9A P51151 3/20 0.66
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
MAPT P10636 2/20 0.66
SLC6A5 Q9Y345 2/20 0.59
AR P10275 1/20 0.57
LMNA P02545 1/20 0.56
NR4A2 P43354 1/20 0.56
RXRA P19793 1/20 0.56
RXRB P28702 1/20 0.56
ALDH1A1 P00352 1/20 0.56
HTT P42858 1/20 0.56
MRGPRX4 Q96LA9 1/20 0.55

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
SCHEMBL509652 1.00 MAOB (0.74) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL11350421 0.88 RAB9A (0.82) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL10236929 0.88 RAB9A (0.82) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL10396483 0.87 NR4A2 (0.74) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL22721357 0.87 MRGPRX4 (0.71) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL13673420 0.87 RAB9A (0.68) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL13439695 0.87 NR4A2 (0.74) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL18002926 0.85 MAOB (1.00) MAOBMEN1KMT2ASMN1; SMN2NR4A2
SCHEMBL4709035 0.84 MAOB (0.77) MAOBMAPTNR4A2HTTMRGPRX4
SCHEMBL6525591 0.84 MAOB (0.76) MAOBNPC1RAB9ASMN1; SMN2NR4A2

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-20040077654-A1 Aryl piperidine and piperazine derivatives as inducers of ldl-receptor expression SMITHKLINE BEECHAM CORPORATION 2004-04-22 US disclosed
EP-1351936-A1 ARYL PIPERIDINE AND PIPERAZINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2003-10-15 EP disclosed
WO-2002055496-A1 ARYL PIPERIDINE AND PIPERAZINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2002-07-18 WO 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-20040077654-A1 Aryl piperidine and piperazine derivatives as inducers of ldl-receptor expression LDLR, NR1H2, NCOR1 MAOB 2608/4885NPC1 18/4885RAB9A 2511/4885

“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.