SCHEMBL3792244

SCHEMBL3792244

O=C1c2ccccc2C(=O)N1CCCCCCc1ccc(Br)cc1

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.77
L3MBTL1 Q9Y468 1/20 0.77
CYP1B1 Q16678 2/20 0.58
HDAC8 Q9BY41 3/20 0.52
HDAC3 O15379 2/20 0.52
HDAC4 P56524 2/20 0.52
HDAC1 Q13547 2/20 0.52
HDAC7 Q8WUI4 2/20 0.52
HDAC2 Q92769 2/20 0.52
HDAC10 Q969S8 2/20 0.52
HDAC11 Q96DB2 2/20 0.52
HDAC6 Q9UBN7 2/20 0.52
HDAC9 Q9UKV0 2/20 0.52
HDAC5 Q9UQL6 2/20 0.52
GSK3A P49840 1/20 0.51
GSK3B P49841 1/20 0.51
ACHE P22303 4/20 0.51

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
SCHEMBL5573576 0.94 TDP1 (0.66) TDP1L3MBTL1CYP1B1GSK3B
SCHEMBL8434811 0.87 TDP1 (1.00) TDP1L3MBTL1CYP1B1GSK3AGSK3B
SCHEMBL31035964 0.87 TDP1 (1.00) TDP1L3MBTL1CYP1B1GSK3AGSK3B
SCHEMBL5093425 0.87 TDP1 (1.00) TDP1L3MBTL1CYP1B1GSK3AGSK3B
SCHEMBL9219707 0.87 TDP1 (1.00) TDP1L3MBTL1CYP1B1GSK3AGSK3B
SCHEMBL29263641 0.87 TDP1 (1.00) TDP1L3MBTL1CYP1B1GSK3AGSK3B
SCHEMBL2187848 0.87 CASP3 (0.65) TDP1L3MBTL1CYP1B1GSK3B
SCHEMBL34464362 0.87 CASP3 (0.65) TDP1L3MBTL1CYP1B1GSK3B
SCHEMBL24340266 0.86 TDP1 (0.79) TDP1L3MBTL1GSK3AGSK3BACHE
SCHEMBL916601 0.85 TDP1 (0.96) TDP1L3MBTL1CYP1B1GSK3AGSK3B

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-7662572-B2 Compositions and liquid crystals PLATYPUS TECHNOLOGIES, LLC. (US) 2010-02-16 US disclosed
US-20070099249-A1 Compositions and liquid crystals PLATYPUS TECHNOLOGIES, LLC (US) 2007-05-03 US disclosed
WO-2007025129-A2 COMPOSITIONS AND LIQUID CRYSTALS PLATYPUS TECHNOLOGIES, LLC. (US) 2007-03-01 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-20070099249-A1 Compositions and liquid crystals FABP5, FABP1, SSB TDP1 3003/4885L3MBTL1 1377/4885CYP1B1 4808/4885

“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.