SCHEMBL11276569

SCHEMBL11276569

COC(C)OC(CBr)CCC=C(C)C

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.37
SRC P12931 1/20 0.33
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL11272333 0.85 LMNA (0.39) ALOX15ALDH1A1TSHRSRC
SCHEMBL11277303 0.83 ALOX15 (0.36) ALOX15ALDH1A1TSHRSRC
SCHEMBL11265398 0.82 ALOX15 (0.40) ALOX15ALDH1A1TSHRSRC
SCHEMBL11269850 0.80 ALOX15 (0.35) ALOX15ALDH1A1TSHR
SCHEMBL11276910 0.78 TSHR (0.35) TSHR
SCHEMBL11275927 0.75 ALOX15 (0.36) ALOX15ALDH1A1TSHR
SCHEMBL11268721 0.71
SCHEMBL11275934 0.71 ALOX15 (0.36) ALOX15ALDH1A1TSHRCYP2D6CYP2C19
SCHEMBL11270315 0.70 ALOX15 (0.34) ALOX15ALDH1A1TSHR
SCHEMBL17131606 0.70 ALOX15 (0.50) ALOX15ALDH1A1TSHRSRC

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-0054909-A2 9-Halo-8-hydroxy-4-methyl-4-nonenoic acids, derivatives thereof and a process for their preparation MITSUBISHI KASEI CORPORATION (JP) 1982-06-30 EP disclosed