SCHEMBL6839745 — predicted protein targets

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	PPARD	Q03181	2/20	0.52

▸	ALDH1A1	P00352	2/20	0.46

▸	TP53	P04637	2/20	0.46

▸	TSHR	P16473	4/20	0.43

▸	TDP1	Q9NUW8	1/20	0.38

▸	CA12	O43570	1/20	0.36

▸	CA1	P00915	1/20	0.36

▸	CA2	P00918	1/20	0.36

▸	CA9	Q16790	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
SCHEMBL7425644	0.88	PPARD (0.56)	PPARDALDH1A1TP53TSHRTDP1
SCHEMBL2383184	0.82	PPARD (0.54)	PPARDALDH1A1TSHRTDP1
SCHEMBL2990604	0.82	PPARD (0.54)	PPARDALDH1A1TSHRCA12CA1
SCHEMBL24475840	0.82	PPARD (0.54)	PPARDTP53TSHRTDP1CA12
SCHEMBL2235112	0.78	CYP1A2 (0.52)	PPARDALDH1A1TSHRTDP1
SCHEMBL11203182	0.78	TSHR (0.52)	PPARDALDH1A1TSHRCA12CA1
SCHEMBL7268189	0.78	PPARD (0.64)	PPARDTP53TSHRTDP1
SCHEMBL5017294	0.78	PPARD (0.64)	PPARDTP53TSHRTDP1
SCHEMBL2463019	0.76	PPARD (0.52)	PPARDTP53TSHRTDP1CA12
SCHEMBL29169497	0.76	PPARD (0.52)	PPARDTSHRCA12CA1CA2

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-2004096237-A2	PHOSPHONATE ANALOGS FOR TREATING METABOLIC DISEASES	GILEAD SCIENCES, INC. (US)	2004-11-11	—	—	WO	disclosed