SCHEMBL9418161

SCHEMBL9418161

Cc1cccc2c1C([Si](C)(C)C1c3ccccc3-c3cccc(C)c31)c1ccccc1-2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
GPR3 P46089 1/20 0.35
GAA P10253 1/20 0.34
TNKS2 Q9H2K2 2/20 0.33
PBRM1 Q86U86 1/20 0.33
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
HTR2C P28335 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
HPGD P15428 1/20 0.33
ACHE P22303 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL30885497 0.87 TNKS2 (0.32) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL6571784 0.81 GPR3 (0.32) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL7580105 0.81 ACHE (0.33) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL5175634 0.80 GPR3 (0.46) GPR3ALDH1A1ACHEPOLB
Hydrochloric Acid SCHEMBL6559588 0.76 GPR3 (0.43) GPR3ALDH1A1ACHEPOLB
Hydrochloric Acid SCHEMBL6559595 0.76 GPR3 (0.43) GPR3GAAALDH1A1ACHEPOLB
SCHEMBL358532 0.75 GPR3 (0.39) GPR3TNKS2PBRM1HTR7HTR2B
SCHEMBL31338566 0.75 GPR3 (0.39) GPR3TNKS2PBRM1HTR7HTR2B
SCHEMBL11783880 0.75 HTR2B (0.51) SMN1; SMN2GPR3TNKS2PBRM1HTR7
SCHEMBL1667065 0.74 HTR2A (0.41) GPR3GAATNKS2PBRM1HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0604908-A2 Metallocene compounds having ligands of fluorenylic type Montell Technology Company bv (NL) 1994-07-06 EP disclosed