SCHEMBL7706248

SCHEMBL7706248

CC(C)(C)c1cccc2c1C([Si](C)(C)Cl)c1ccccc1-2

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GPR3 P46089 1/20 0.31

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
SCHEMBL29596197 0.77 GPR3 (0.43) ALDH1A1GPR3
SCHEMBL2480013 0.77 GPR3 (0.43) ALDH1A1GPR3
SCHEMBL5177268 0.75 CA2 (0.38) CA2ALDH1A1TSHRTDP1GPR3
SCHEMBL29565918 0.73 CA2 (0.36) CA2ALDH1A1TSHRTDP1GPR3
SCHEMBL18418381 0.73 CA2 (0.45) CA2ALDH1A1TSHRTDP1GPR3
SCHEMBL27730134 0.73 CA2 (0.36) CA2ALDH1A1TSHRTDP1GPR3
SCHEMBL3683683 0.73
Hydrochloric Acid SCHEMBL5347713 0.72 CA2 (0.35) CA2ALDH1A1TSHRTDP1GPR3
SCHEMBL5982512 0.71 ALDH1A1 (0.36) CA2ALDH1A1TSHRTDP1GPR3
SCHEMBL7604199 0.71 HTR2A (0.40) CA2ALDH1A1TSHRTDP1GPR3

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-6448349-B1 STEREORIGID METALLOCENE FOR BLOCK GAS PHASE POLYMERIZING OLEFINS HAVING THREE OR MORE CARBON ATOMS FINA RESEARCH, S.A. (BE) 2002-09-10 US disclosed
EP-1049741-A2 POLYOLEFINS AND USES THEREOF FINA RESEARCH S.A. (BE) 2000-11-08 EP disclosed
WO-1999037711-A2 POLYOLEFINS AND USES THEREOF FINA RESEARCH S.A. (BE) 1999-07-29 WO disclosed