SCHEMBL9540221

C[C@H](NC(=O)[C@H](C)N1C(=O)CCC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N([N+]=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	TACR1	P25103	12/20	0.48

▸	CMA1	P23946	4/20	0.46

▸	ACE	P12821	3/20	0.44

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
SCHEMBL8333459	0.92	PSMB9 (0.47)	TACR1
SCHEMBL1289940	0.89	CMA1 (0.54)	TACR1CMA1ACE
SCHEMBL7410732	0.88	ELANE (0.43)	CMA1ACE
SCHEMBL7213508	0.88	TACR1 (0.49)	TACR1CMA1ACE
SCHEMBL8664555	0.88	TACR1 (0.48)	TACR1CMA1ACE
SCHEMBL7874280	0.86	EPHA2 (0.43)	ACE
SCHEMBL7351756	0.84	TACR1 (0.52)	TACR1
SCHEMBL5062693	0.81	TACR1 (0.43)	TACR1CMA1ACE
SCHEMBL410223	0.79	FKBP4 (0.54)	TACR1CMA1
SCHEMBL5063463	0.77	OPRM1 (0.45)	TACR1

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-1993002696-A1	T-CELL MEMBRANE PROTEIN FOR B CELL IG CLASS SWITCHING	MEDICAL BIOLOGY INSTITUTE (US)	1993-02-18	—	—	WO	disclosed