SCHEMBL11575726

SCHEMBL11575726

CCCCCCCCCCC(C(=O)Br)C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
EPHX1 P07099 9/20 0.43
EPHX2 P34913 2/20 0.43
TSHR P16473 1/20 0.43
NAAA Q02083 3/20 0.41
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL2555573 0.85 LCK (0.50) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL3272020 0.85 LCK (0.50) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL5385696 0.85 LCK (0.50) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL9861922 0.85 LCK (0.50) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL2555276 0.85 LCK (0.50) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL10494941 0.85 LCK (0.50) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL28418904 0.85 LCK (0.50) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL181506 0.85 LCK (0.50) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL8736617 0.85 LCK (0.50) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL2703033 0.84 LCK (0.44) LCKPPARDZDHHC20ZDHHC2EPHX1

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
US-4097665-A Diacylnucleosides and process for preparing the same ASAHI KASEI KOGYO KABUSHIKI KAISHA (JA) 1978-06-27 US disclosed