SCHEMBL30091689 — predicted protein targets

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	RPS6KB1	P23443	2/20	0.38

▸	NTRK1	P04629	3/20	0.34

▸	GPR52	Q9Y2T5	7/20	0.33

▸	PARP10	Q53GL7	1/20	0.32

▸	DHODH	Q02127	2/20	0.32

▸	AURKA	O14965	1/20	0.32

▸	PARP1	P09874	1/20	0.32

▸	PARP2	Q9UGN5	1/20	0.32

▸	MEN1	O00255	1/20	0.30

▸	KMT2A	Q03164	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
SCHEMBL30091570	0.84	GPR52 (0.43)	RPS6KB1NTRK1GPR52AURKA
SCHEMBL23927479	0.83	TSHR (0.39)	NTRK1MEN1KMT2A
SCHEMBL30091457	0.83	TSHR (0.39)	NTRK1MEN1KMT2A
SCHEMBL30091645	0.82	GPR52 (0.45)	GPR52PARP1
SCHEMBL30091639	0.81	GPR52 (0.36)	RPS6KB1GPR52AURKAPARP1
SCHEMBL15964837	0.80	HCAR2 (0.46)	RPS6KB1GPR52PARP10PARP1
SCHEMBL15964865	0.79	MAOB (0.39)	PARP10
SCHEMBL15964821	0.78	NR3C2 (0.45)	RPS6KB1AURKAPARP1
SCHEMBL30091705	0.76	MMP13 (0.41)	DHODHPARP1
SCHEMBL23927445	0.75	NTRK1 (0.43)	NTRK1MEN1KMT2A

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
CN-113166116-B	Amido bridged heterocyclic compound, and composition and application thereof	北京赛特明强医药科技有限公司	2022-12-27	—	—	CN	disclosed