SCHEMBL6938543

SCHEMBL6938543

CCCCCCCc1ccc(C(=O)CCCl)cc1

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRA P10827 14/20 0.77
THRB P10828 14/20 0.77
HAO1 Q9UJM8 1/20 0.61
RARB P10826 4/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
ALDH1A1 P00352 1/20 0.58
RARA P10276 1/20 0.58
MAPT P10636 1/20 0.58
MTOR P42345 1/20 0.58

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
SCHEMBL13730713 1.00 THRA (0.77) THRATHRBHAO1RARBMEN1
SCHEMBL3234253 0.93 THRA (0.66) THRATHRBHAO1RARBALDH1A1
SCHEMBL11440891 0.88 THRA (0.79) THRATHRBHAO1RARB
SCHEMBL15960542 0.88 THRA (0.79) THRATHRBHAO1RARBMEN1
SCHEMBL11380651 0.87 THRA (1.00) THRATHRBHAO1RARBMEN1
SCHEMBL11664808 0.87 THRA (1.00) THRATHRBHAO1RARBMEN1
SCHEMBL6937309 0.86 L3MBTL1 (0.69) THRATHRBKMT2AALDH1A1MAPT
SCHEMBL6556728 0.85 THRA (0.55) THRATHRBHAO1
SCHEMBL8549508 0.85 THRA (0.97) THRATHRBHAO1RARBMEN1
SCHEMBL24777868 0.84 THRA (0.72) THRATHRBHAO1RARBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0953150-B1 MODULAR SENSOR SYSTEM FOR THE INDUSTRIAL PROCESS MEASUREMENT TECHNIQUE EIDGENOESSISCHE TECH HOCHSCHULE ZUERICH (CH) 2003-01-15 EP disclosed
US-6409909-B1 MULTIDIMENSIONAL SYSTEM FOR THE REAGENT-FREE, CONTINUOUS DETECTION OF A SUBSTANCE; AMPEROMETRY AND OPTICAL SENSORS; EIDGENOSSISCHE TECHNISCHE HOCHSCHULE ZURICH (CH) 2002-06-25 US disclosed