SCHEMBL27916633

SCHEMBL27916633

CC=C(C)CCC=C(C)CCC=C(C)C.[NaH].[NaH].[NaH].[NaH]

nearest known ligand 0.76

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.76
MAPT P10636 2/20 0.67
MEN1 O00255 2/20 0.67
CYP3A4 P08684 2/20 0.67
ALOX15 P16050 2/20 0.67
ALDH1A1 P00352 2/20 0.67
UGT1A1 P22309 1/20 0.67
SQLE Q14534 7/20 0.64
KDM4E B2RXH2 1/20 0.59
FNTA P49354 1/20 0.53
FNTB P49356 1/20 0.53

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
SCHEMBL12713311 0.97 KMT2A (0.80) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL12377558 0.97 KMT2A (0.80) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL6716175 0.97 KMT2A (0.80) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL3090338 0.97 KMT2A (0.80) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL3092587 0.97 KMT2A (0.80) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL17047981 0.97 KMT2A (0.80) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL10510234 0.97 KMT2A (0.80) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL3090339 0.97 KMT2A (0.80) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL28731350 0.97 KMT2A (0.80) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL27497319 0.95 KMT2A (0.67) KMT2AMAPTMEN1CYP3A4ALOX15

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
CN-105051195-A Methods for increasing rebaudioside D and rebaudioside M production EVOLVA SA 2015-11-11 CN disclosed
CN-104884631-A Methods for producing heterologous polypeptides in mutants of trichoderma NOVOZYMES INC 2015-09-02 CN disclosed
CN-103282492-A Modified valencene synthase polypeptides, encoding nucleic acid molecules and uses thereof ALLYLIX INC 2013-09-04 CN disclosed