SCHEMBL10525902

SCHEMBL10525902

C=CC(=O)OC(C)CC[Si](OCCC)(OCCC)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
THRB P10828 4/20 0.35
THRA P10827 1/20 0.33
CTSK P43235 2/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CTSH P09668 1/20 0.32
LMNA P02545 2/20 0.32
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL10525599 0.90 ALDH1A1 (0.34) ALDH1A1THRBTHRACTSKCTSL
SCHEMBL10526785 0.85 THRB (0.35) ALDH1A1THRBTHRACTSKCTSL
SCHEMBL3307216 0.83 ALDH1A1 (0.35) ALDH1A1CTSKCTSLCTSBCTSH
SCHEMBL27323436 0.82 TSHR (0.42) ALDH1A1THRBTHRACTSKLMNA
SCHEMBL1066699 0.81 THRB (0.48) ALDH1A1THRBTHRALMNAHPGD
SCHEMBL15603389 0.81 ALDH1A1 (0.33) ALDH1A1LMNA
SCHEMBL1063249 0.79 TSHR (0.49) ALDH1A1THRBTHRALMNAHPGD
SCHEMBL7873872 0.78 TSHR (0.48) ALDH1A1THRBTHRALMNAHPGD
SCHEMBL27979653 0.78 TSHR (0.38) ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL1066701 0.78 THRB (0.38) ALDH1A1THRBTHRALMNAHPGD

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
US-4886852-A PREPARING NONAQUEOUS DISPERSION IN ORGANIC SOLVENT, THEN NEUTRALIZATION KANSAI PAINT COMPANY, LIMITED (JP) 1989-12-12 US claimed
US-4886852-A PREPARING NONAQUEOUS DISPERSION IN ORGANIC SOLVENT, THEN NEUTRALIZATION KANSAI PAINT COMPANY, LIMITED (JP) 1989-12-12 US disclosed