SCHEMBL23407853

CC(C)COC(=O)CN(CC(=O)OCC(C)C)C(CCCCNC(=O)CCC(NC(=S)Nc1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1)C(=O)NCCCCC(C(=O)OCC(C)C)N(CC(=O)OCC(C)C)CC(=O)OCC(C)C)C(=O)OCC(C)C

nearest known ligand 0.50

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	CA1	P00915	9/20	0.50

▸	CA2	P00918	9/20	0.50

▸	CA9	Q16790	9/20	0.50

▸	CA12	O43570	6/20	0.50

▸	ALB	P02768	2/20	0.47

▸	CA14	Q9ULX7	2/20	0.47

▸	CA7	P43166	2/20	0.47

▸	FOLH1	Q04609	1/20	0.46

▸	FKBP1A	P62942	3/20	0.45

▸	ELF3	P78545	2/20	0.45

▸	MED23	Q9ULK4	2/20	0.45

▸	HTR3A	P46098	2/20	0.44

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
SCHEMBL23407854	0.92	CA1 (0.46)	CA1CA2CA9CA12ALB
SCHEMBL23407863	0.91	CA1 (0.59)	CA1CA2CA9CA12CA14
SCHEMBL23407864	0.88	CA1 (0.50)	CA1CA2CA9CA12ALB
SCHEMBL23407852	0.85	CA1 (0.47)	CA1CA2CA9CA12ALB
SCHEMBL21186772	0.78	CA9 (0.65)	CA1CA2CA9CA12CA14
SCHEMBL12291693	0.78	CA9 (0.58)	CA1CA2CA9CA12ALB
SCHEMBL23407865	0.78	CA1 (0.64)	CA1CA2CA9CA12CA14
SCHEMBL13062332	0.77	CA9 (0.57)	CA1CA2CA9CA12ALB
SCHEMBL21610017	0.76	CA9 (0.53)	CA1CA2CA9CA12ALB
SCHEMBL14089612	0.76	CA9 (0.66)	CA1CA2CA9CA12CA14

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-20210156867-A1	QUINOLINE BASED CYANINE DYE TURN-ON FLUORESCENT PROBES AND METHODS OF USE THEREOF	YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL)	2021-05-27	—	—	US	disclosed