SCHEMBL4775293

SCHEMBL4775293

CC/C=C/C(=O)OC1CCCCC1OC(=O)/C=C/CC

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
EPHX1 P07099 1/20 0.34
ATM Q13315 1/20 0.34
SERPINE1 P05121 2/20 0.33
NAAA Q02083 2/20 0.33
MAPT P10636 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
SCHEMBL4775297 1.00 MEN1 (0.34) MEN1KMT2AEPHX1ATMSERPINE1
SCHEMBL28444127 0.87 MEN1 (0.30) MEN1KMT2A
SCHEMBL9561774 0.85 EPHX1 (0.46) EPHX1NAAA
SCHEMBL9561777 0.85 EPHX1 (0.46) EPHX1NAAA
SCHEMBL9561874 0.83 EPHX1 (0.49) EPHX1NAAA
SCHEMBL9862944 0.83 EPHX1 (0.49) EPHX1NAAA
SCHEMBL9561873 0.83 EPHX1 (0.49) EPHX1NAAA
SCHEMBL4781593 0.78 ATM (0.37) MEN1KMT2AATMSERPINE1
SCHEMBL4781594 0.78 ATM (0.37) MEN1KMT2AATMSERPINE1
SCHEMBL4625976 0.76 ATM (0.36) MEN1KMT2AEPHX1ATMSERPINE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008004788-A1 NOVEL DERIVATIVES OF CYCLIC COMPOUND AND THE USE THEREOF WONKISOPHARM CO., LTD. (KR) 2008-01-10 WO claimed
US-8420853-B2 Derivatives of cyclic compound and the use thereof Wonkisopharm Co., Ltd (KR) 2013-04-16 US disclosed
WO-2008004788-A1 NOVEL DERIVATIVES OF CYCLIC COMPOUND AND THE USE THEREOF WONKISOPHARM CO., LTD. (KR) 2008-01-10 WO disclosed