SCHEMBL6327653

SCHEMBL6327653

CCCCCC(C#N)C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.38
CYP1A2 P05177 1/20 0.36
EPHX1 P07099 3/20 0.33
SIGMAR1 Q99720 1/20 0.33
TSHR P16473 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
SCHEMBL9650913 0.98 SHBG (0.36) SHBGCYP1A2EPHX1SIGMAR1TSHR
SCHEMBL28027285 0.94 SHBG (0.39) SHBGCYP1A2EPHX1SIGMAR1TSHR
SCHEMBL11158410 0.86 SHBG (0.41) SHBGCYP1A2EPHX1
SCHEMBL9248578 0.84 TSHR (0.37) TSHR
SCHEMBL7458138 0.81 SHBG (0.38) SHBGCYP1A2EPHX1TSHR
SCHEMBL10747853 0.80 HSD17B10 (0.52) SHBGEPHX1TSHR
SCHEMBL7457530 0.80 TSHR (0.38) EPHX1TSHR
SCHEMBL7458659 0.80 TSHR (0.38) EPHX1TSHR
SCHEMBL7453115 0.80 TSHR (0.38) EPHX1TSHR
SCHEMBL7457424 0.80 TSHR (0.38) EPHX1TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6924873-B2 Liquid crystal display device and its production method Asada, Tadahiro (JP) 2005-08-02 US disclosed
US-20040246431-A1 Liquid crystal display device and its production method ASADA TADAHIRO (JP) 2004-12-09 US disclosed