SCHEMBL8433925

SCHEMBL8433925

C=CC(O)(CCCC)CCCC

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
ALDH1A1 P00352 1/20 0.38
FDPS P14324 10/20 0.33
GGPS1 O95749 6/20 0.33
ALOX15 P16050 2/20 0.32
MEN1 O00255 1/20 0.32
CYP3A4 P08684 1/20 0.32
KMT2A Q03164 1/20 0.32
HPGD P15428 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL28803556 0.92 FDPS (0.41) TSHRALDH1A1FDPSGGPS1
SCHEMBL31648195 0.90 FDPS (0.43) TSHRFDPSGGPS1
SCHEMBL10900101 0.88 FDPS (0.39) TSHRALDH1A1FDPSGGPS1
SCHEMBL4175937 0.83 FDPS (0.35) TSHRFDPSALOX15MEN1CYP3A4
SCHEMBL2754123 0.83 FDPS (0.39) TSHRALDH1A1FDPSGGPS1
SCHEMBL6152478 0.81
SCHEMBL27690967 0.80 FDPS (0.39) TSHRALDH1A1FDPSGGPS1MEN1
SCHEMBL10678172 0.80
SCHEMBL10678184 0.80
SCHEMBL27474936 0.79

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-5929298-A Process for preparing conjugated dienes using substituted rhenium trioxide EASTMAN CHEMICAL COMPANY (US) 1999-07-27 US disclosed
US-5929298-A Process for preparing conjugated dienes using substituted rhenium trioxide EASTMAN CHEMICAL COMPANY (US) 1999-07-27 US disclosed