SCHEMBL9204484

SCHEMBL9204484

[CH2]CC(CCCCCCCC)C1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.34
SIGMAR1 Q99720 2/20 0.34
TSHR P16473 1/20 0.34
EPHX1 P07099 4/20 0.33
EPHX2 P34913 1/20 0.33

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
SCHEMBL9207424 1.00 SHBG (0.34) SHBGSIGMAR1TSHREPHX1EPHX2
SCHEMBL9209181 0.98 SHBG (0.38) SHBGSIGMAR1TSHREPHX1EPHX2
SCHEMBL10472499 0.98 SHBG (0.38) SHBGSIGMAR1TSHREPHX1EPHX2
SCHEMBL9210781 0.98 SHBG (0.38) SHBGSIGMAR1TSHREPHX1EPHX2
SCHEMBL108105 0.98 SHBG (0.35) SHBGSIGMAR1TSHREPHX1
SCHEMBL1524594 0.96 SHBG (0.39) SHBGSIGMAR1TSHREPHX1EPHX2
SCHEMBL9205067 0.92 SHBG (0.37) SHBGSIGMAR1
SCHEMBL1524470 0.92 LMNA (0.35) TSHR
SCHEMBL28859417 0.88 SHBG (0.39) SHBGSIGMAR1TSHREPHX1
SCHEMBL29322013 0.88 SHBG (0.39) SHBGSIGMAR1TSHREPHX1

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-0421441-B1 Pantothenic acid derivatives FUJIREBIO KK (JP) 1995-01-25 EP disclosed
US-5120738-A Cardiovascular disorders FUJIREBIO INC. (JP) 1992-06-09 US disclosed
EP-0421441-A2 Pantothenic acid derivatives FUJIREBIO INC. (JP) 1991-04-10 EP disclosed