SCHEMBL4967244

SCHEMBL4967244

C[Si](C)(C)O[Si](C)(C)CCC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.38
LMNA P02545 4/20 0.36
EGLN1 Q9GZT9 2/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
SUCNR1 Q9BXA5 1/20 0.36
FFAR3 O14843 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
SLC15A2 Q16348 1/20 0.35
SLC22A6 Q4U2R8 2/20 0.33
ALDH1A1 P00352 3/20 0.32
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
PHF8 Q9UPP1 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
AKR1B1 P15121 1/20 0.32
NFKB1 P19838 1/20 0.32
PMP22 Q01453 1/20 0.32

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
SCHEMBL513566 0.90 TSHR (0.41) TSHRLMNAEGLN1ALKBH5SUCNR1
Hydrochloric Acid SCHEMBL11148349 0.88 TSHR (0.39) TSHRLMNAEGLN1ALKBH5SUCNR1
SCHEMBL8674170 0.85 LMNA (0.46) TSHRLMNASLC22A6ALDH1A1AKR1B1
SCHEMBL526437 0.81 LMNA (0.36) TSHRLMNAEGLN1ALKBH5SUCNR1
SCHEMBL30612730 0.81 LMNA (0.36) TSHRLMNAEGLN1ALKBH5SUCNR1
SCHEMBL30612731 0.81 LMNA (0.36) TSHRLMNAEGLN1ALKBH5SUCNR1
SCHEMBL13051353 0.81 ALDH1A1 (0.41) TSHRLMNASLC15A2ALDH1A1
SCHEMBL17035392 0.80 TSHR (0.44) TSHRLMNASLC22A6ALDH1A1NFKB1
SCHEMBL1581340 0.79 TET2 (0.31)
SCHEMBL29005749 0.79 CAMK2A (0.44) TSHRLMNASLC22A6ALDH1A1AKR1B1

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-1968642-A2 KERATIN-BINDING EFFECTOR MOLECULES AND METHOD FOR THE PRODUCTION THEREOF BY COUPLING KERATIN-BINDING POLYPEPTIDES WITH EFFECTOR MOLECULES WHICH SUPPORT CARBOXYLIC GROUPS OR SULFONIC ACID GROUPS BASF SE (DE) 2008-09-17 EP disclosed
WO-2007060116-A2 KERATIN-BINDING EFFECTOR MOLECULES AND METHOD FOR THE PRODUCTION THEREOF BY COUPLING KERATIN-BINDING POLYPEPTIDES WITH EFFECTOR MOLECULES THAT SUPPORT CARBOXYLIC GROUPS OR SULFONIC ACID GROUPS BASF SE (DE) 2007-05-31 WO disclosed
US-4247674-A Use of bis(fluoroaliphaticsulfonyl)imides in polymerization of organocyclosiloxanes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1981-01-27 US disclosed