SCHEMBL14045641

CCC(C)(CC)c1ccc(-c2ccc(N3C(=O)c4ccc(S(=O)(=O)c5ccc6c(c5)C(=O)N(C(C)(CC)CC)C6=O)cc4C3=O)cc2C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	CA9	Q16790	10/20	0.41

▸	CA1	P00915	8/20	0.41

▸	CA2	P00918	8/20	0.41

▸	CA12	O43570	5/20	0.41

▸	ALDH1A1	P00352	1/20	0.32

▸	MEN1	O00255	1/20	0.31

▸	KMT2A	Q03164	1/20	0.31

▸	CA4	P22748	3/20	0.31

▸	POLB	P06746	1/20	0.31

▸	CNR2	P34972	1/20	0.30

▸	NR3C1	P04150	1/20	0.30

▸	PGR	P06401	1/20	0.30

▸	AR	P10275	1/20	0.30

▸	CRHR1	P34998	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
SCHEMBL14045733	0.88	CA9 (0.35)	CA9CA1CA2CA12ALDH1A1
SCHEMBL13515115	0.87	CA9 (0.36)	CA9CA1CA2CA12ALDH1A1
SCHEMBL14045642	0.86	BRD4 (0.39)	CA9CA1CA2CA12ALDH1A1
SCHEMBL14045732	0.85	CA9 (0.42)	CA9CA1CA2CA12ALDH1A1
SCHEMBL24452956	0.81	CA9 (0.34)	CA9CA1CA2CA12CRHR1
SCHEMBL14444166	0.81	CA9 (0.34)	CA9CA1CA2CA12CRHR1
SCHEMBL25751363	0.81	ALDH1A1 (0.37)	CA9CA1CA2CA12ALDH1A1
SCHEMBL12994884	0.80	CA9 (0.44)	CA9CA1CA2CA12ALDH1A1
SCHEMBL18132899	0.80	CA9 (0.37)	CA9CA1CA2CA12ALDH1A1
SCHEMBL19522999	0.79	DPP8 (0.36)	CA9CA1CA2CA12ALDH1A1

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
US-20080248273-A1	Polymer, Method For Producing the Polymer, Optical Film, and Image Display Device	FUJIFILM CORPORATION (JP)	2008-10-09	—	—	US	disclosed