SCHEMBL18028239

SCHEMBL18028239

C=C(c1ccc(OCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1)c1ccc(OCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB1 P20618 1/20 0.41
PSMB5 P28074 1/20 0.41
PSMB2 P49721 1/20 0.41
MAPT P10636 2/20 0.36
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
PPARA Q07869 1/20 0.36
PRSS1 P07477 3/20 0.36
TMPRSS2 O15393 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PRMT1 Q99873 3/20 0.35
F2 P00734 2/20 0.35
ST14 Q9Y5Y6 2/20 0.35
PLAU P00749 1/20 0.35
GAA P10253 1/20 0.35
PRMT5 O14744 1/20 0.35
SLC22A2 O15244 1/20 0.35
SLC22A1 O15245 1/20 0.35
PTP4A3 O75365 1/20 0.35
SLC22A3 O75751 1/20 0.35

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
SCHEMBL18028235 0.95 PPARA (0.44) PSMB1PSMB5PSMB2MAPTPPARA
SCHEMBL25788217 0.82 PKM (0.53) USP2TSHRL3MBTL1
SCHEMBL3274146 0.81 PPARA (0.60) MAPTPPARAL3MBTL1GAA
SCHEMBL3424352 0.81 HRH3 (0.42) PPARAHRH3
SCHEMBL3779536 0.81 HRH3 (0.42) PPARAHRH3
SCHEMBL5489747 0.80 MAOB (0.35) MAPTUSP2TSHRPPARA
SCHEMBL5959986 0.80 KCNA3 (0.50) PPARADRD3
SCHEMBL3480749 0.79 CHRNB4 (0.43) MAPTPPARA
SCHEMBL27096233 0.79 HRH3 (0.43) PPARAHRH3
SCHEMBL1751270 0.79 APP (0.34)

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-20160244557-A1 BLOCK COPOLYMERS WITH SURFACE-ACTIVE JUNCTION GROUPS, COMPOSITIONS AND PROCESSES THEREOF AZ ELECTRONIC MATERIALS (LUXEMBOURG) S. a. r. l. (LU) 2016-08-25 US disclosed