SCHEMBL10332443

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)OC[C@H]1O[C@@H](n2cc(F)c(=O)[nH]c2=O)[C@H](O)[C@@H]1O

nearest known ligand 0.44

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	TYMS	P04818	1/20	0.40

▸	NTSR2	O95665	1/20	0.39

▸	NTSR1	P30989	1/20	0.39

▸	P2RY6	Q15077	2/20	0.38

▸	P2RY14	Q15391	2/20	0.38

▸	BACE1	P56817	3/20	0.38

▸	NT5E	P21589	1/20	0.38

▸	F2	P00734	1/20	0.36

▸	AGTR2	P50052	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
SCHEMBL9638312	1.00	TYMS (0.40)	TYMSNTSR2NTSR1P2RY6P2RY14
SCHEMBL9638316	1.00	TYMS (0.40)	TYMSNTSR2NTSR1P2RY6P2RY14
Hydrochloric Acid SCHEMBL9638288	0.99	TYMS (0.40)	TYMSNTSR2NTSR1P2RY6P2RY14
Hydrochloric Acid SCHEMBL10332231	0.99	TYMS (0.40)	TYMSNTSR2NTSR1P2RY6P2RY14
Hydrochloric Acid SCHEMBL9638281	0.99	TYMS (0.40)	TYMSNTSR2NTSR1P2RY6P2RY14
Hydrochloric Acid SCHEMBL9638076	0.99	TYMS (0.40)	TYMSNTSR2NTSR1P2RY6P2RY14
SCHEMBL10332186	0.92	P2RY6 (0.44)	P2RY6P2RY14NT5E
SCHEMBL10332184	0.92	P2RY6 (0.44)	P2RY6P2RY14NT5E
Hydrochloric Acid SCHEMBL9636947	0.91	P2RY6 (0.43)	P2RY6P2RY14NT5E
Hydrochloric Acid SCHEMBL9636952	0.91	P2RY6 (0.43)	P2RY6P2RY14NT5E

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-4892939-A	ANTITUMOR, ANTIVIRAL AND IMMUNOSUPRESSIVE AGENTS	FUJI KAGAKU KOGYO KABUSHIKI KAISHA (JP)	1990-01-09	—	—	US	claimed