SCHEMBL7995818 — predicted protein targets

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	CYP1A2	P05177	2/20	0.41

▸	NAAA	Q02083	7/20	0.40

▸	TLR4	O00206	1/20	0.38

▸	CYP3A4	P08684	1/20	0.38

▸	CYP2C8	P10632	1/20	0.38

▸	CYP2D6	P10635	1/20	0.38

▸	CYP2C9	P11712	1/20	0.38

▸	CYP2C19	P33261	1/20	0.38

▸	S1PR3	Q99500	1/20	0.38

▸	KDM5A	P29375	2/20	0.36

▸	PHF8	Q9UPP1	2/20	0.36

▸	KDM2A	Q9Y2K7	2/20	0.36

▸	KDM4C	Q9H3R0	1/20	0.36

▸	KDM4A	O75164	1/20	0.36

▸	CCR2	P41597	1/20	0.36

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
SCHEMBL5274773	0.89	CYP1A2 (0.45)	CYP1A2TLR4CYP3A4CYP2C8CYP2D6
SCHEMBL7741173	0.87	CYP1A2 (0.52)	CYP1A2NAAACYP3A4CYP2C8CYP2D6
SCHEMBL7739414	0.87	CYP1A2 (0.52)	CYP1A2NAAACYP3A4CYP2C8CYP2D6
SCHEMBL7737822	0.87	CYP1A2 (0.52)	CYP1A2NAAACYP3A4CYP2C8CYP2D6
SCHEMBL7741474	0.86	CYP1A2 (0.53)	CYP1A2NAAACYP3A4CYP2C8CYP2D6
SCHEMBL1830401	0.83	CYP1A2 (0.42)	CYP1A2TLR4
SCHEMBL7733050	0.83	CYP1A2 (0.59)	CYP1A2TLR4
SCHEMBL7739575	0.83	CYP1A2 (0.59)	CYP1A2TLR4
SCHEMBL7741618	0.83	CYP1A2 (0.59)	CYP1A2TLR4
SCHEMBL3323738	0.83	CYP1A2 (0.53)	CYP1A2NAAACCR2

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
WO-2001032645-A1	THE SYNTHESIS OF EXTENDED BIS(ETHYLENEDITHIO)TETRATHIAFULVALENE DERIVATIVES AND THEIR DIHYDROXYL ANALOGUES	TUBITAK-MARMARA RESEARCH CENTER (TR)	2001-05-10	—	—	WO	disclosed