SCHEMBL7991744

SCHEMBL7991744

C=CCCCC=C(C)CCC=CCCCC(=CCC)CC

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LSS P48449 3/20 0.33
SQLE Q14534 2/20 0.33
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
KMT2A Q03164 1/20 0.31
CNR1 P21554 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
SCHEMBL8167679 0.82 TSHR (0.37)
SCHEMBL8167682 0.82 TSHR (0.37)
SCHEMBL847258 0.82 TSHR (0.42)
SCHEMBL847257 0.82 TSHR (0.42)
SCHEMBL7624837 0.78 TSHR (0.40) LSSSQLEKMT2ACNR1
SCHEMBL849105 0.77 TSHR (0.43)
SCHEMBL849106 0.77 TSHR (0.43)
SCHEMBL9646005 0.76 TSHR (0.46) KMT2A
SCHEMBL9646001 0.76 TSHR (0.46) KMT2A
SCHEMBL4428119 0.74 TSHR (0.38) KMT2A

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-6274678-B1 USING COORDINATION CATALYST MITSUI CHEMICALS INC (JP) 2001-08-14 US disclosed