SCHEMBL7038401

SCHEMBL7038401

CC(Cn1c(-c2nc3ccccc3s2)nc2ccccc21)C[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.42
TSHR P16473 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
HTT P42858 2/20 0.42
KDM4E B2RXH2 7/20 0.41
ALDH1A1 P00352 5/20 0.41
HPGD P15428 2/20 0.41
PRKACA P17612 1/20 0.39
RPS6KB1 P23443 1/20 0.39
GSK3B P49841 1/20 0.39
ROCK1 Q13464 1/20 0.39
RAB9A P51151 5/20 0.38
MAPT P10636 3/20 0.38
PAX8 Q06710 1/20 0.38
NOD2 Q9HC29 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37

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
SCHEMBL927722 0.81 HPGD (0.39) LMNATSHRSMN1; SMN2HTTKDM4E
SCHEMBL8104229 0.72 ALDH1A1 (0.42) LMNATSHRSMN1; SMN2HTTKDM4E
SCHEMBL29979980 0.71 HTT (0.43) LMNATSHRSMN1; SMN2HTTKDM4E
SCHEMBL1020149 0.71 HTT (0.43) LMNATSHRSMN1; SMN2HTTKDM4E
SCHEMBL14582034 0.71 TLR8 (0.55) LMNATSHRSMN1; SMN2HTTKDM4E
SCHEMBL7040964 0.70 HSD17B10 (0.64) LMNATSHRSMN1; SMN2HTTKDM4E
SCHEMBL7035923 0.69 KDM4E (0.59) LMNATSHRSMN1; SMN2HTTKDM4E
SCHEMBL9331260 0.64 MAPK1 (0.53) LMNATSHRSMN1; SMN2HTTKDM4E
SCHEMBL13451647 0.61 KDM4E (0.67) LMNATSHRKDM4EALDH1A1HPGD
SCHEMBL5390832 0.61 ILK (0.44) LMNATSHRSMN1; SMN2KDM4EALDH1A1

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-1028120-B1 Organosilicon compounds with N-substituted benzimidazole-benzazole or benzofuranyl-benzazole groups, sunscreen compositions containing these compounds and their use OREAL (FR) 2003-03-19 EP disclosed
US-6221343-B1 Benzimidazole/benzofuryl-benzazole silicon compounds and UV-photoprotective compositions comprised thereof SOCIETE L'OREAL S.A. (FR) 2001-04-24 US disclosed
EP-1028120-A1 Organosilicon compounds with N-substituted benzimidazole-benzazole or benzofuranyl-benzazole groups, sunscreen compositions containing these compounds and their use L'OREAL (FR) 2000-08-16 EP disclosed