SCHEMBL2138939

SCHEMBL2138939

C=C(C(=O)O)C(C)(C)CC.C=C(C(=O)O)C(C)(C)CC

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 1/20 0.38
RIPK1 Q13546 5/20 0.34
FFAR3 O14843 1/20 0.32
HMGCR P04035 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31
ADRA1A P35348 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL1963590 1.00 TET2 (0.38) TET2RIPK1FFAR3HMGCRCHRM1
Hydrochloric Acid SCHEMBL28222918 0.95 TET2 (0.35) TET2RIPK1
SCHEMBL6450320 0.80 TET2 (0.35) TET2FFAR3ALDH1A1
SCHEMBL6445901 0.79 TET2 (0.38) TET2FFAR3HMGCRCHRM1TBXA2R
SCHEMBL3775748 0.77 TET2 (0.37) TET2
SCHEMBL1135248 0.77 KDM4E (0.39) TET2
SCHEMBL2672128 0.77 TET2 (0.46) TET2FFAR3HMGCRCHRM1TBXA2R
SCHEMBL9346344 0.77 TET2 (0.37) TET2
SCHEMBL3229799 0.77 TDP1 (0.39) RIPK1
SCHEMBL28357690 0.77 TET2 (0.37) TET2TSHR

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-20120101231-A1 Polymer Composition prepared from acrylic polymer grafted with a functionalized block copolymers KRATON POLYMERS U.S. LLC (US) 2012-04-26 US disclosed
US-20100130670-A1 END USE APPLICATIONS PREPARED FROM CERTAIN BLOCK COPOLYMERS KRATON POLYMERS US LLC (US) 2010-05-27 US disclosed
US-20090093584-A1 End Use Applications Prepared From Certain Block Copolymers KRATON POLYMERS U.S. LLC (US) 2009-04-09 US disclosed