SCHEMBL31060963

CC[C@H](C)[C@@H]1NC(=O)[C@H](CS)N(C(C)=O)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O

nearest known ligand 0.56

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	SRC	P12931	2/20	0.56

▸	CD2	P06729	1/20	0.52

▸	CD58	P19256	1/20	0.52

▸	PLG	P00747	1/20	0.46

▸	MLNR	O43193	1/20	0.45

▸	SSTR4	P31391	10/20	0.44

▸	SSTR2	P30874	9/20	0.44

▸	SSTR3	P32745	9/20	0.44

▸	SSTR5	P35346	9/20	0.44

▸	SSTR1	P30872	5/20	0.44

▸	OXTR	P30559	1/20	0.43

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
SCHEMBL31603772	0.73	SOAT2 (0.51)	SRCCD2CD58
SCHEMBL30317658	0.73	SOAT2 (0.51)	SRCCD2CD58
SCHEMBL31603773	0.73	SOAT2 (0.51)	SRCCD2CD58
SCHEMBL20465923	0.71	SSTR4 (0.63)	SSTR4SSTR2SSTR3SSTR5SSTR1
SCHEMBL38652044	0.71	HDAC3 (0.50)	SRCMLNR
SCHEMBL30317494	0.71	HDAC3 (0.50)	SRCMLNR
SCHEMBL30426495	0.71	HDAC3 (0.50)	SRCMLNR
SCHEMBL30317633	0.71	HDAC3 (0.50)	SRCMLNR
SCHEMBL29905030	0.71	HDAC3 (0.50)	SRCMLNR
SCHEMBL30317520	0.71	HDAC3 (0.50)	SRCMLNR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-4662319-A2	PERSONALIZED CRISPR PROFILING FOR CANCER	Integrate Bioscience LLC (US)	2025-12-17	—	—	EP	disclosed
WO-2024168301-A2	PERSONALIZED CRISPR PROFILING FOR CANCER	FUNCTION ONCOLOGY, INC. (US)	2024-08-15	—	—	WO	disclosed