SCHEMBL9716076

SCHEMBL9716076

CCO[Si](CCCc1ccccc1)(OCC)OCCCCl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.38
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DRD3 P35462 2/20 0.36
CHRM2 P08172 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
CHRM1 P11229 1/20 0.36
DRD1 P21728 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADRA1A P35348 1/20 0.36
OPRM1 P35372 1/20 0.36
SLC6A3 Q01959 1/20 0.36
KCNH2 Q12809 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
KMT2A Q03164 3/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL27646102 0.93 RAB9A (0.37) IDO1RAB9ASMN1; SMN2DRD3CHRM2
SCHEMBL15387165 0.87 CHRM2 (0.44) IDO1RAB9ASMN1; SMN2DRD3CHRM2
Hydrogen Sulfide SCHEMBL21291580 0.86 CHRM2 (0.43) IDO1DRD3CHRM2HTR1AADRA2A
SCHEMBL28052746 0.84 MAOA (0.44) IDO1SMN1; SMN2LMNA
SCHEMBL28045043 0.83 LMNA (0.33) RAB9ASMN1; SMN2HTR1AADRA1AKMT2A
SCHEMBL6327518 0.82 L3MBTL1 (0.44) IDO1DRD3CHRM2HTR1AADRA2A
SCHEMBL27418301 0.82 MAOA (0.47) IDO1SMN1; SMN2LMNASIGMAR1
SCHEMBL11275819 0.81 IDO1 (0.48) IDO1RAB9ASMN1; SMN2DRD3DRD2
SCHEMBL16552905 0.81 SIGMAR1 (0.46) DRD3CHRM2HTR1AADRA2ACHRM1
SCHEMBL16552928 0.81 SIGMAR1 (0.46) DRD3CHRM2HTR1AADRA2ACHRM1

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
EP-0477765-A2 Thermoplastic, coupled barrier composites THE B.F. GOODRICH COMPANY (US) 1992-04-01 EP disclosed
US-4146585-A COPOLYMER CONTAINING VINYL CHLORIDE AND HYDROXYALKYL ACRYLATE UNION CARBIDE CORPORATION (US) 1979-03-27 US disclosed
US-4113691-A PHENYLENE ETHER POLYMER UNION CARBIDE CORPORATION (US) 1978-09-12 US disclosed