SCHEMBL21441047

CCN(CC)CCn1c2ccc(C(C)=O)cc2c2cc(C(=O)CCC(=O)c3ccc4c(c3)c3c(OC)c(C(=O)CCC(=O)c5ccc6c(c5)c5cc(C(C)=O)c(F)cc5n6CCN(CC)CC)ccc3n4CCN(CC)CC)c(C)cc21

nearest known ligand 0.34

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	CNR2	P34972	2/20	0.34

▸	MCHR1	Q99705	1/20	0.33

▸	ALDH1A1	P00352	1/20	0.32

▸	HPGD	P15428	1/20	0.32

▸	HRH3	Q9Y5N1	2/20	0.31

▸	MEN1	O00255	2/20	0.30

▸	KMT2A	Q03164	2/20	0.30

▸	PTGER4	P35408	1/20	0.30

▸	MAPT	P10636	1/20	0.30

▸	ATM	Q13315	1/20	0.30

▸	L3MBTL1	Q9Y468	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.

Compound	similarity	top predicted	shared targets
SCHEMBL12608659	0.82	CNR2 (0.44)	CNR2MCHR1ALDH1A1HPGD
SCHEMBL12608660	0.82	CNR2 (0.43)	CNR2ALDH1A1HPGDMEN1KMT2A
SCHEMBL12608665	0.79	CNR2 (0.45)	CNR2ALDH1A1HPGDMEN1KMT2A
SCHEMBL12608658	0.78	CNR2 (0.44)	CNR2MCHR1ALDH1A1HPGDMEN1
SCHEMBL12608666	0.77	MCHR1 (0.45)	CNR2MCHR1ALDH1A1HPGDMEN1
SCHEMBL14549016	0.76	CNR2 (0.41)	CNR2ALDH1A1HPGDMEN1KMT2A
SCHEMBL21441034	0.75	CNR2 (0.38)	CNR2MCHR1ALDH1A1MEN1KMT2A
SCHEMBL13418975	0.74	HPGD (0.40)	CNR2ALDH1A1HPGDMAPT
SCHEMBL12608661	0.74	CNR2 (0.44)	CNR2ALDH1A1HPGDMEN1KMT2A
SCHEMBL12608637	0.72	CNR2 (0.51)	CNR2ALDH1A1HPGDMEN1KMT2A

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-2294186-B1	INDUCING CELL DEATH BY INHIBITING ADAPTIVE HEAT SHOCK RESPONSE	INCURON INC (US)	2019-10-09	—	—	EP	disclosed