SCHEMBL16280855

SCHEMBL16280855

CCO[Si](CCCNCC(O)COCCC[Si](OC)(OC)OC)(OCC)OCC

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
CASR P41180 2/20 0.36
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 1/20 0.33
ADRB2 P07550 3/20 0.32
ADRB1 P08588 2/20 0.32
ADRB3 P13945 1/20 0.32
USP2 O75604 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HTT P42858 1/20 0.31

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
SCHEMBL18635974 0.96 KDM4E (0.37) KDM4ECASRALDH1A1KMT2AADRB2
SCHEMBL16280900 0.92 KDM4E (0.42) KDM4ECASRALDH1A1KMT2AADRB2
SCHEMBL62207 0.92 KDM4E (0.41) KDM4ECASRALDH1A1KMT2AADRB2
SCHEMBL14865789 0.91 KDM4E (0.36) KDM4ECASRALDH1A1KMT2AUSP2
SCHEMBL9606976 0.90 KDM4E (0.38) KDM4ECASRALDH1A1KMT2AUSP2
SCHEMBL18102291 0.89 KDM4E (0.39) KDM4ECASRALDH1A1KMT2AADRB2
SCHEMBL15218997 0.88 KDM4E (0.40) KDM4ECASRALDH1A1KMT2AADRB2
SCHEMBL61312 0.87 KDM4E (0.42) KDM4ECASRALDH1A1KMT2AADRB2
SCHEMBL9606985 0.87 KDM4E (0.38) KDM4ECASRALDH1A1KMT2AUSP2
SCHEMBL28020280 0.86 KDM4E (0.42) KDM4ECASRALDH1A1KMT2AADRB2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10295108-B2 Modified hybrid silica aerogels ASPEN AEROGELS, INC. (US) 2019-05-21 US disclosed
US-20170074449-A1 MODIFIED HYBRID SILICA AEROGELS MIDCAP FUNDING IV TRUST 2017-03-16 US disclosed
US-9512287-B2 Modified hybrid silica aerogels ASPEN AEROGELS, INC. (US) 2016-12-06 US disclosed
US-20150065590-A1 MODIFIED HYBRID SILICA AEROGELS MIDCAP FUNDING IV TRUST 2015-03-05 US disclosed
US-8906973-B2 Modified hybrid silica aerogels ASPEN AEROGELS, INC. (US) 2014-12-09 US disclosed