SCHEMBL6441199

SCHEMBL6441199

CCC=CC(=O)OCCC[SiH2]C(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
LMNA P02545 2/20 0.39
MDM4 O15151 1/20 0.39
MDM2 Q00987 1/20 0.39
ATM Q13315 1/20 0.37
APP P05067 5/20 0.37
HCAR2 Q8TDS4 4/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
AKR1B10 O60218 2/20 0.36
AKR1B1 P15121 2/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL3101734 0.87 HCAR2 (0.38) MAPTLMNAMDM4MDM2ATM
SCHEMBL4661265 0.81 THRB (0.50) LMNAHCAR2NPC1RAB9ASMN1; SMN2
SCHEMBL7256806 0.75 ATM (0.43) MAPTATMAPPHCAR2RAB9A
SCHEMBL3101738 0.75 TDP1 (0.46) LMNANPC1RAB9ASMN1; SMN2CHRM2
SCHEMBL4661596 0.70 HTT (0.32) LMNASMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL9561881 0.69 ATM (0.76) MAPTATMAPPHCAR2RAB9A
SCHEMBL690840 0.69 ATM (0.76) MAPTATMAPPHCAR2RAB9A
SCHEMBL690841 0.69 ATM (0.76) MAPTATMAPPHCAR2RAB9A
SCHEMBL7187261 0.68 HCAR2 (0.67) MAPTLMNAHCAR2AKR1B10AKR1B1
SCHEMBL1879191 0.68 HCAR2 (0.67) MAPTLMNAHCAR2AKR1B10AKR1B1

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-1519968-A1 LOW WATER CONTENT HIGH REFRACTIVE INDEX, FLEXIBLE, POLYMERIC COMPOSITIONS BAUSCH & LOMB INCORPORATED (US) 2005-04-06 EP claimed
WO-2004000901-A1 LOW WATER CONTENT HIGH REFRACTIVE INDEX, FLEXIBLE, POLYMERIC COMPOSITIONS BAUSCH & LOMB INCORPORATED (US) 2003-12-31 WO claimed