SCHEMBL23818768

C=C(C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)Nc1nc(-c2csc(C(=O)N[C@@H](CC(C)C)C(=O)Nc3nc(-c4csc(C(=O)N[C@H](C(=O)Nc5nccs5)C(C)CC)c4)cs3)c2)cs1

nearest known ligand 0.53

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	HSPA5	P11021	8/20	0.53

▸	HSPA2	P54652	5/20	0.53

▸	HSPA8	P11142	2/20	0.53

▸	HSPA9	P38646	2/20	0.53

▸	F2RL1	P55085	1/20	0.42

▸	TAS1R3	Q7RTX0	1/20	0.39

▸	TAS1R1	Q7RTX1	1/20	0.39

▸	AGTR2	P50052	1/20	0.39

▸	CTSS	P25774	4/20	0.38

▸	CTSL	P07711	3/20	0.38

▸	CTSK	P43235	2/20	0.37

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
SCHEMBL23818759	0.93	HSPA5 (0.63)	HSPA5HSPA2HSPA8HSPA9F2RL1
SCHEMBL23818454	0.80	HSPA5 (0.61)	HSPA5HSPA2HSPA9AGTR2CTSL
SCHEMBL23818463	0.78	HSPA5 (0.72)	HSPA5HSPA2HSPA8HSPA9TAS1R3
SCHEMBL23804624	0.72	HSPA5 (1.00)	HSPA5HSPA2HSPA8HSPA9TAS1R3
SCHEMBL23804620	0.72	HSPA5 (1.00)	HSPA5HSPA2HSPA8HSPA9TAS1R3
SCHEMBL23818889	0.65	HSPA5 (1.00)	HSPA5HSPA2HSPA8HSPA9AGTR2
SCHEMBL23818887	0.64	HSPA5 (1.00)	HSPA5HSPA2HSPA9CTSK
SCHEMBL25286173	0.64	TAS1R3 (0.73)	F2RL1TAS1R3TAS1R1CTSSCTSL
SCHEMBL25244468	0.64	TAS1R3 (0.73)	F2RL1TAS1R3TAS1R1CTSSCTSL
SCHEMBL8558332	0.64	HSPA5 (0.71)	HSPA5HSPA2HSPA8HSPA9

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-2021183942-A1	INHIBITORS OF HSP70 PROTEINS	ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US)	2021-09-16	—	—	WO	disclosed