SCHEMBL17987724

CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@H](CN=[N+]=[N-])Cc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCC(=O)N2CCC(C(C)=O)CC2)C(C)C)cc1)OC)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	CYP3A4	P08684	1/20	0.47

▸	FOLH1	Q04609	3/20	0.45

▸	TTR	P02766	2/20	0.41

▸	SSTR2	P30874	2/20	0.34

▸	NECTIN4	Q96NY8	1/20	0.34

▸	FAP	Q12884	4/20	0.33

▸	OXTR	P30559	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
SCHEMBL17987755	0.97	CYP3A4 (0.48)	CYP3A4FOLH1TTRSSTR2NECTIN4
SCHEMBL20800164	0.97	CYP3A4 (0.47)	CYP3A4FOLH1TTRSSTR2NECTIN4
SCHEMBL20800166	0.97	CYP3A4 (0.48)	CYP3A4FOLH1TTRSSTR2NECTIN4
SCHEMBL20800177	0.94	CYP3A4 (0.46)	CYP3A4FOLH1TTRSSTR2NECTIN4
SCHEMBL24193297	0.94	CYP3A4 (0.52)	CYP3A4FOLH1TTRSSTR2NECTIN4
SCHEMBL23764860	0.92	CYP3A4 (0.45)	CYP3A4FOLH1TTRSSTR2NECTIN4
SCHEMBL23764785	0.92	CYP3A4 (0.45)	CYP3A4FOLH1TTRSSTR2NECTIN4
SCHEMBL24465502	0.91	CYP3A4 (0.44)	CYP3A4FOLH1TTRSSTR2NECTIN4
SCHEMBL19084353	0.91	CYP3A4 (0.49)	CYP3A4FOLH1TTRSSTR2NECTIN4
SCHEMBL19084307	0.91	CYP3A4 (0.49)	CYP3A4FOLH1TTRSSTR2NECTIN4

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-2016123412-A1	ANTIBODY DRUG CONJUGATES	SORRENTO THERAPEUTICS, INC. (US)	2016-08-04	—	—	WO	disclosed