SCHEMBL7813917

SCHEMBL7813917

O=C(O)C(CCc1ccccc1)[SiH2]c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ACE P12821 1/20 0.44
▸ KEAP1 Q14145 1/20 0.42
▸ ANPEP P15144 2/20 0.42
▸ ERAP1 Q9NZ08 2/20 0.42
▸ ERAP2 Q6P179 1/20 0.42
▸ MME P08473 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ PPARG P37231 1/20 0.42
▸ PPARA Q07869 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42

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
SCHEMBL28432437 0.75 CNR2 (0.42) CNR2TSHRSMN1; SMN2HPGDANPEP
SCHEMBL2291948 0.74 MMP8 (0.56) CNR2TSHRSMN1; SMN2KEAP1ANPEP
SCHEMBL28028204 0.74 CNR2 (0.46) CNR2TSHRSMN1; SMN2MEN1HTT
SCHEMBL1857365 0.72 CYP1A2 (0.61) KEAP1ANPEPERAP1ERAP2
SCHEMBL28904693 0.72 CNR2 (0.40) CNR2TSHRSMN1; SMN2HPGDKEAP1
SCHEMBL233440 0.71 CNR2 (0.50) CNR2TSHRSMN1; SMN2MEN1HTT
SCHEMBL7439193 0.71 GRIK1 (0.64) ANPEPERAP1ERAP2
SCHEMBL360781 0.71 CNR2 (0.50) CNR2TSHRSMN1; SMN2MEN1HTT
Water SCHEMBL4010621 0.71 CYP1A2 (0.59) CNR2ANPEPERAP1ERAP2
SCHEMBL7439191 0.71 GRIK1 (0.64) ANPEPERAP1ERAP2

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-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 — — EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 — — WO disclosed
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