SCHEMBL13216865

SCHEMBL13216865

CCC(C)(C)C(=O)OCCNC(=O)NCCC[Si](Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
POLB P06746 2/20 0.36
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
IDO1 P14902 1/20 0.36
RIPK1 Q13546 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
EPHX1 P07099 3/20 0.34
HTT P42858 1/20 0.34
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL12134708 0.79 EPHX1 (0.33) TSHREPHX1
SCHEMBL801356 0.77 SMN1; SMN2 (0.53) L3MBTL1NPC1RAB9AALDH1A1TSHR
SCHEMBL13130663 0.77 TAAR1 (0.46) L3MBTL1MTNR1AMTNR1BNPC1RAB9A
SCHEMBL13667487 0.75 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2EPHX1HTTKMT2A
SCHEMBL13667491 0.71 ITGB3 (0.54) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL13336624 0.71 HTT (0.39) NPC1TDP1ALDH1A1TSHRSMN1; SMN2
SCHEMBL12134721 0.70 RECQL (0.40) RECQLL3MBTL1MTNR1AMTNR1BPOLB
SCHEMBL116844 0.70 THRB (0.51) RECQLL3MBTL1MTNR1AMTNR1BNPC1
SCHEMBL12126303 0.70 PRSS1 (0.40) NPC1RAB9ASMN1; SMN2
SCHEMBL19822033 0.70 EPHX1 (0.33) IDO1EPHX1KMT2A

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-20100200207-A1 HYDROPHILIC COMPOSITION FUJIFILM CORPORATION (JP) 2010-08-12 US disclosed