SCHEMBL4459255

Cc1cc(C)c(-c2ccc3c(c2-c2c(C)cc(C)cc2C(C)(C)C)-c2c(-c4c(C)cc(C)cc4C(C)(C)C)c(-c4c(C)cc(C)cc4C(C)(C)C)c(P(O)O)c(P(O)O)c2-3)c(C(C)(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	SMN1; SMN2	Q16637	2/20	0.36

▸	ALDH1A1	P00352	1/20	0.36

▸	CA2	P00918	1/20	0.36

▸	POLB	P06746	1/20	0.36

▸	TYR	P14679	1/20	0.36

▸	HSPA5	P11021	1/20	0.31

▸	CYP2C9	P11712	2/20	0.31

▸	CYP2C19	P33261	2/20	0.31

▸	HIF1A	Q16665	2/20	0.31

▸	CYP2D6	P10635	1/20	0.31

▸	HSD17B10	Q99714	1/20	0.31

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
SCHEMBL4451308	0.77	ALDH1A1 (0.33)	SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL4459579	0.73	—	—
SCHEMBL5155174	0.72	ALDH1A1 (0.41)	SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL10781802	0.69	ALDH1A1 (0.32)	SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL919405	0.69	ALDH1A1 (0.33)	ALDH1A1HSD17B10
SCHEMBL11301324	0.69	PDK2 (0.37)	SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL7809388	0.68	TDP1 (0.47)	SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL8359846	0.66	SMN1; SMN2 (0.39)	SMN1; SMN2ALDH1A1CA2POLBTYR
SCHEMBL8378734	0.65	ESR2 (0.35)	CYP2C9CYP2C19
SCHEMBL2958450	0.65	CA2 (0.33)	CA2

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-20090069171-A1	Catalysts for olefin polymerization, process for production of the catalysts, and method for preservation thereof	JAPAN POLYPROPYLENE CORPORATION (JP)	2009-03-12	—	—	US	disclosed