SCHEMBL8925519

SCHEMBL8925519

COc1ccc(OC(=O)c2ccc(OCCC[Si](C)(C)O[SiH](C)C)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.48
CYP1A2 P05177 3/20 0.48
CYP2C9 P11712 3/20 0.48
CYP2C19 P33261 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 3/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
MAPT P10636 5/20 0.46
KMT2A Q03164 5/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
PRSS1 P07477 2/20 0.44
ACR P10323 2/20 0.44
GFER P55789 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.41

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
SCHEMBL12749048 0.83 MAPT (0.51) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL8927099 0.83 TSHR (0.55) TSHRALDH1A1
SCHEMBL12749046 0.81 MAPT (0.48) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL13205233 0.80 LMNA (0.50) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL14566203 0.79 LMNA (0.67) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL3462397 0.79 GAA (0.55) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL11911717 0.77 LMNA (0.47) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL12744489 0.77 MAPT (0.56) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL23771262 0.76 LMNA (0.72) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL18722269 0.76 NPC1 (0.58) LMNACYP1A2CYP2C9CYP2C19SMN1; SMN2

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
US-5605649-A LOW VISCOSITY, THERMOCHROMIC PROPERTIES CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1997-02-25 US disclosed