SCHEMBL6161443

Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)CN(C(=O)[C@@H](Cc2ccc4ccccc4c2)NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C3)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	P2RX7	Q99572	2/20	0.47

▸	KMT2A	Q03164	4/20	0.45

▸	MAPK1	P28482	1/20	0.43

▸	F2	P00734	2/20	0.43

▸	MEN1	O00255	1/20	0.42

▸	F10	P00742	1/20	0.42

▸	STS	P08842	1/20	0.42

▸	ALDH1A1	P00352	1/20	0.42

▸	LIMK2	P53671	1/20	0.42

▸	TGFBR1	P36897	2/20	0.42

▸	PLAU	P00749	1/20	0.41

▸	PLAT	P00750	1/20	0.41

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
SCHEMBL6166209	0.84	MAPK1 (0.49)	KMT2AMAPK1F10STSALDH1A1
SCHEMBL6166213	0.84	MAPK1 (0.49)	KMT2AMAPK1F10STSALDH1A1
SCHEMBL6161724	0.84	MAPK1 (0.50)	KMT2AMAPK1MEN1STSALDH1A1
SCHEMBL6161717	0.84	MAPK1 (0.50)	KMT2AMAPK1MEN1STSALDH1A1
SCHEMBL6162910	0.83	MAPK1 (0.48)	P2RX7KMT2AMAPK1STSALDH1A1
SCHEMBL6168374	0.82	MAPK1 (0.51)	KMT2AMAPK1F10STS
SCHEMBL6168383	0.82	MAPK1 (0.51)	KMT2AMAPK1F10STS
SCHEMBL6163821	0.82	MAPK1 (0.48)	KMT2AMAPK1STSALDH1A1
Hydrochloric Acid SCHEMBL6169194	0.80	F2 (0.43)	P2RX7F2F10PLAU
SCHEMBL6161457	0.79	KCNA1 (0.47)	F2F10ALDH1A1

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
EP-0828754-B1	DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE	PFIZER (US)	2005-02-02	—	—	EP	disclosed