SCHEMBL7601892

SCHEMBL7601892

CO[Si](CCCC(=O)NCCCO)(OC)OC

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
CNR1 P21554 2/20 0.45
NAAA Q02083 1/20 0.44
POLB P06746 1/20 0.41
TP53 P04637 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RECQL P46063 1/20 0.40
DNM1 Q05193 1/20 0.40
CASP2 P42575 1/20 0.39
LMNA P02545 1/20 0.39
FAAH O00519 1/20 0.39
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
BCHE P06276 1/20 0.38
CHRM2 P08172 1/20 0.38
ACHE P22303 1/20 0.38

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
SCHEMBL16907942 0.93 TSHR (0.50) TSHRCNR1NAAAPOLBTP53
SCHEMBL18164189 0.87 TSHR (0.55) TSHRNAAAPOLBRECQLDNM1
SCHEMBL27805033 0.86 CASP2 (0.52) TSHRCNR1NAAAL3MBTL1DNM1
SCHEMBL22174072 0.85 TSHR (0.52) TSHRNAAAPOLBL3MBTL1RECQL
SCHEMBL31074224 0.84 TSHR (0.52) TSHRNAAAPOLBRECQLDNM1
SCHEMBL25801633 0.82 CASP2 (0.52) TSHRCNR1NAAAL3MBTL1DNM1
SCHEMBL27628884 0.82 TSHR (0.46) TSHRPOLBRECQLCASP2FAAH
SCHEMBL19083849 0.80 CASP2 (0.58) TSHRNAAACASP2FAAH
SCHEMBL16422261 0.79 TSHR (0.41) TSHRNAAAPOLBCASP2FAAH
SCHEMBL24844352 0.79 EPHX2 (0.51) TSHRCNR1POLBMAPK1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020028455-A1 Methods and reagents for assembling molecules on solid supports MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2002-03-07 US disclosed
WO-2001083826-A2 METHODS AND REAGENTS FOR ASSEMBLING MOLECULES ON SOLID SUPPORTS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2001-11-08 WO disclosed