SCHEMBL14730585

SCHEMBL14730585

C=CCC/C=C(\C)CCO

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SQLE Q14534 7/20 0.61
KMT2A Q03164 3/20 0.46
LSS P48449 3/20 0.46
ALOX15 P16050 3/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
CYP3A4 P08684 2/20 0.41
ALDH1A1 P00352 1/20 0.41
UGT1A1 P22309 1/20 0.41
ICMT O60725 1/20 0.37

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
SCHEMBL8669624 0.85 LSS (0.58) SQLEKMT2ALSSALOX15MAPT
SCHEMBL8669621 0.85 LSS (0.58) SQLEKMT2ALSSALOX15MAPT
SCHEMBL846897 0.81 KMT2A (0.46) SQLEKMT2ALSSALOX15MAPT
SCHEMBL846896 0.81 KMT2A (0.46) SQLEKMT2ALSSALOX15MAPT
SCHEMBL24208137 0.80
SCHEMBL29736318 0.80
SCHEMBL12164488 0.80
SCHEMBL6738088 0.79
SCHEMBL138767 0.79 KMT2A (0.77) SQLEKMT2ALSSALOX15MAPT
SCHEMBL2231674 0.79 KMT2A (0.77) SQLEKMT2ALSSALOX15MAPT

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
EP-2562161-A1 5-FLUORO PYRIMIDINE DERIVATIVES AS FUNGICIDES Dow AgroSciences LLC (US) 2013-02-27 EP disclosed