SCHEMBL759637

SCHEMBL759637

CCCCCCCCC(I)CCC

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
THRB P10828 1/20 0.44
LMNA P02545 1/20 0.44
DNM1 Q05193 2/20 0.43
OPRM1 P35372 1/20 0.42
GPR84 Q9NQS5 3/20 0.39
FDPS P14324 3/20 0.39
SPHK1 Q9NYA1 1/20 0.39
FFAR1 O14842 1/20 0.39
MAPT P10636 1/20 0.38
LCK P06239 1/20 0.38
PPARD Q03181 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 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
SCHEMBL1000743 1.00 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL25254117 0.97 OPRM1 (0.43) TSHRTHRBLMNADNM1OPRM1
SCHEMBL18324135 0.94 TSHR (0.50) TSHRTHRBLMNADNM1OPRM1
SCHEMBL21436918 0.94 TSHR (0.50) TSHRTHRBLMNADNM1OPRM1
SCHEMBL1333027 0.94 TSHR (0.50) TSHRTHRBLMNADNM1OPRM1
SCHEMBL1001552 0.94 TSHR (0.50) TSHRTHRBLMNADNM1OPRM1
SCHEMBL2507860 0.94 TSHR (0.50) TSHRTHRBLMNADNM1OPRM1
SCHEMBL1335362 0.94 TSHR (0.50) TSHRTHRBLMNADNM1OPRM1
SCHEMBL17879364 0.94 TSHR (0.50) TSHRTHRBLMNADNM1OPRM1
SCHEMBL18107259 0.92 DNM1 (0.52) TSHRTHRBLMNADNM1OPRM1

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-2307116-B1 METHOD FOR SELECTIVELY EXTRACTING MEMBRANE PROTEINS USING CALIXARENES CENTRE NAT RECH SCIENT (FR) 2012-03-21 EP disclosed
EP-2307116-A1 METHOD FOR SELECTIVELY EXTRACTING MEMBRANE PROTEINS USING CALIXARENES Centre National de la Recherche Scientifique - CNRS (FR) 2011-04-13 EP disclosed
WO-2009144419-A1 METHOD FOR SELECTIVELY EXTRACTING MEMBRANE PROTEINS USING CALIXARENES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE - CNRS (FR) 2009-12-03 WO disclosed