SCHEMBL17617030

SCHEMBL17617030

CO[Si](CCCNCC(O)COc1ccc(C(C)(C)c2ccc(OCC(O)COc3ccc(C(C)(C)c4ccc(OCC(O)CNCCC[Si](OC)(OC)OC)cc4)cc3)cc2)cc1)(OC)OC

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ADRB3 P13945 6/20 0.51
ADRB2 P07550 4/20 0.51
ADRB1 P08588 4/20 0.51
MAPT P10636 2/20 0.48
GAA P10253 1/20 0.48
HTT P42858 1/20 0.47
HIF1A Q16665 1/20 0.47
AR P10275 1/20 0.46
CASR P41180 1/20 0.43

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
SCHEMBL13757935 0.84 MEN1 (0.58) MEN1KMT2AADRB3ADRB2ADRB1
SCHEMBL20441143 0.81 KDM4E (0.60) ALDH1A1KDM4EMEN1KMT2AADRB3
SCHEMBL9606981 0.78 MEN1 (0.44) ALDH1A1KDM4EMEN1KMT2AADRB3
SCHEMBL20436116 0.77 KDM4E (0.55) ALDH1A1KDM4EMEN1KMT2AADRB3
SCHEMBL1708894 0.77 HTT (0.65) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL20653853 0.76 KDM4E (0.52) ALDH1A1KDM4EMEN1KMT2AADRB3
SCHEMBL12892709 0.76 HTT (0.57) ALDH1A1KDM4EMEN1KMT2AADRB3
SCHEMBL14978759 0.74 HTT (0.61) ALDH1A1KDM4EMEN1KMT2AADRB2
SCHEMBL25085429 0.74 KMT2A (0.69) ALDH1A1KDM4EMEN1KMT2AADRB3
SCHEMBL20441142 0.74 KDM4E (0.57) ALDH1A1KDM4EMEN1KMT2AADRB3

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
US-20170369729-A1 PRIMERLESS HARDCOAT COMPOSITION MOMENTIVE PERFORMANCE MATERIALS INC. 2017-12-28 US disclosed
US-9822220-B2 Antifouling system comprising silicone hydrogel MOMENTATIVE PERFORMANCE MATERIALS, INC. (US) 2017-11-21 US disclosed
US-20160083622-A1 ANTIFOULING SYSTEM COMPRISING SILICONE HYDROGEL MOMENTATIVE PERFORMANCE MATERIALS, INC. (US) 2016-03-24 US disclosed