SCHEMBL6709258

SCHEMBL6709258

COC(=O)c1ccc2oc(-c3ccc(C(F)(F)F)cc3)cc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.56
TNKS O95271 1/20 0.48
HDAC6 Q9UBN7 2/20 0.47
MAOB P27338 1/20 0.46
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
MYC P01106 1/20 0.44
MAX P61244 1/20 0.44
AR P10275 1/20 0.43
CYP1A1 P04798 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2E1 P05181 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C8 P10632 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2A6 P11509 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP4B1 P13584 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
SCHEMBL6485304 0.89 TNKS (0.57) TNKSHDAC6TP53POLBTHRB
SCHEMBL27077411 0.84 TNKS (0.46) FFAR1TNKSMAOBMYCMAX
SCHEMBL3377936 0.84 FFAR1 (0.64) FFAR1TNKSHDAC6MAOBHDAC3
SCHEMBL6709151 0.83 RAB9A (0.54) TNKSHDAC6TP53POLBTHRB
SCHEMBL979282 0.83 APP (0.58) TNKSHDAC6MAOBCYP3A4TP53
SCHEMBL980266 0.83 TNKS (0.56) FFAR1TNKSHDAC6MAOBTP53
SCHEMBL6707948 0.82 HDAC6 (0.56) FFAR1TNKSHDAC6TP53POLB
SCHEMBL9133186 0.79 HDAC6 (0.50) TNKSHDAC6HDAC3HDAC1HDAC2
SCHEMBL3923815 0.78 APP (0.65) TNKSHDAC6HDAC3HDAC1HDAC2
SCHEMBL13063663 0.76 LMNA (0.56) NOTUM

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 FFAR1 5/4885TNKS 4267/4885HDAC6 179/4885

“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.