SCHEMBL11277223

SCHEMBL11277223

CCCCC(Br)/C=C/C(Br)CCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.39
TSHR P16473 5/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
LCK P06239 1/20 0.34
PPARD Q03181 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
CYP3A4 P08684 2/20 0.33
LMNA P02545 1/20 0.33
FDPS P14324 1/20 0.33
ACHE P22303 1/20 0.33
BACE1 P56817 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
TRPA1 O75762 1/20 0.32
DDAH1 O94760 1/20 0.32
GAPDH P04406 1/20 0.32
MAPT P10636 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL11277225 1.00 DNM1 (0.39) DNM1TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL11288754 0.92 TSHR (0.39) DNM1TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL11288755 0.92 TSHR (0.39) DNM1TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL11278482 0.90 DNM1 (0.33) DNM1TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL11278487 0.90 DNM1 (0.33) DNM1TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL11341460 0.87
SCHEMBL11341458 0.87
SCHEMBL11277744 0.87 LCK (0.40) DNM1TSHRLCKPPARDZDHHC20
SCHEMBL11277737 0.87 LCK (0.40) DNM1TSHRLCKPPARDZDHHC20
SCHEMBL11285485 0.83 TSHR (0.32) DNM1TSHRSMN1; SMN2ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0000555-B1 PROCESS FOR THE PREPARATION OF OXIRANES SUBSTITUTED BY HALOGEN ALKYL BAYER AG (DE) 1982-02-10 EP disclosed
EP-0000554-B1 PROCESS FOR THE PREPARATION OF OXIRANES SUBSTITUTED BY HALOGEN ALKYL BAYER AG (DE) 1982-02-10 EP disclosed
EP-0000555-A1 Process for the preparation of oxiranes substituted by halogen alkyl BAYER AG (DE) 1979-02-07 EP disclosed
EP-0000554-A1 Process for the preparation of oxiranes substituted by halogen alkyl BAYER AG (DE) 1979-02-07 EP disclosed