SCHEMBL6525591

SCHEMBL6525591

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

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.76
NR4A2 P43354 5/20 0.73
RXRA P19793 5/20 0.73
RXRB P28702 5/20 0.73
MRGPRX4 Q96LA9 1/20 0.70
NR4A1 P22736 1/20 0.66
NR4A3 Q92570 1/20 0.66
NPC1 O15118 1/20 0.65
POLB P06746 1/20 0.65
RAB9A P51151 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
RXRG P48443 1/20 0.64
PPARA Q07869 1/20 0.64
SRD5A2 P31213 2/20 0.60

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
SCHEMBL19951231 1.00 MAOB (0.76) MAOBNR4A2RXRARXRBMRGPRX4
SCHEMBL8134318 0.87 NR4A2 (0.85) NR4A2RXRARXRBNR4A1NR4A3
SCHEMBL30576796 0.86 MAOB (1.00) MAOBNR4A2MRGPRX4
SCHEMBL18002926 0.86 MAOB (1.00) MAOBNR4A2RXRARXRBSMN1; SMN2
SCHEMBL9813418 0.84 RXRA (1.00) MAOBNR4A2RXRARXRBNR4A1
SCHEMBL22721344 0.84 MRGPRX4 (0.70) NR4A2RXRARXRBMRGPRX4NR4A1
SCHEMBL8459965 0.84 RXRA (1.00) MAOBNR4A2RXRARXRBNR4A1
SCHEMBL23605980 0.84 PPARA (0.75) MAOBMRGPRX4SMN1; SMN2PPARA
SCHEMBL21991486 0.84 MAOB (0.67) MAOBMRGPRX4PPARA
SCHEMBL3498978 0.84 MAOB (0.67) MAOBRXRARXRBMRGPRX4RXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680150-B2 Small molecule hematopoietic growth factor mimetic compounds that activate hematopoietic growth factor receptors LIGAND PHARMACEUTICALS, INC. (US) 2014-03-25 US disclosed
US-20110003851-A1 SMALL MOLECULE HEMATOPOIETIC GROWTH FACTOR MIMETIC COMPOUNDS THAT ACTIVATE HEMATOPOIETIC GROWTH FACTOR RECEPTORS LIGAND PHARMACEUTICALS, INC. (US) 2011-01-06 US disclosed
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 (2 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-20110003851-A1 SMALL MOLECULE HEMATOPOIETIC GROWTH FACTOR MIMETIC COMPOUNDS THAT ACTIVATE HEMATOPOIETIC GROWTH FACTOR RECEPTORS MPL, CSF3R, CSF1R MAOB 4672/4885NR4A2 632/4885RXRA 650/4885
US-20040077654-A1 Aryl piperidine and piperazine derivatives as inducers of ldl-receptor expression LDLR, NR1H2, NCOR1 MAOB 2608/4885NR4A2 147/4885RXRA 139/4885

“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.