Dimethylamine

SCHEMBL10425391

CC(C)(C)OC(=O)NC[C@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)O)CC1.CNC

nearest known ligand 0.79

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	KMT2A	Q03164	6/20	0.79

▸	ATM	Q13315	2/20	0.79

▸	MEN1	O00255	1/20	0.77

▸	MAPK1	P28482	1/20	0.59

▸	LMNA	P02545	1/20	0.57

▸	TDP1	Q9NUW8	1/20	0.57

▸	ACE	P12821	1/20	0.51

▸	ACACB	O00763	2/20	0.49

▸	ACACA	Q13085	2/20	0.49

▸	CTSS	P25774	2/20	0.47

▸	CTSL	P07711	1/20	0.47

▸	CTSB	P07858	1/20	0.47

▸	CTSK	P43235	1/20	0.47

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
SCHEMBL388984	0.98	KMT2A (0.82)	KMT2AATMMEN1MAPK1LMNA
SCHEMBL28057007	0.98	KMT2A (0.82)	KMT2AATMMEN1MAPK1LMNA
SCHEMBL388983	0.98	KMT2A (0.82)	KMT2AATMMEN1MAPK1LMNA
SCHEMBL7275174	0.91	KMT2A (0.72)	KMT2AATMMEN1MAPK1LMNA
SCHEMBL7275179	0.91	KMT2A (0.72)	KMT2AATMMEN1MAPK1LMNA
SCHEMBL16604417	0.90	KMT2A (0.70)	KMT2AATMMEN1MAPK1LMNA
SCHEMBL25964562	0.90	KMT2A (0.70)	KMT2AATMMEN1MAPK1LMNA
Aminobenzoic Acid SCHEMBL7274588	0.89	KMT2A (0.70)	KMT2AATMMEN1MAPK1LMNA
SCHEMBL17982949	0.89	KMT2A (0.69)	KMT2AATMMEN1MAPK1LMNA
SCHEMBL16604445	0.89	KMT2A (0.69)	KMT2AATMMEN1MAPK1LMNA

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
US-4954512-A	Anti-ulcer composition	Okamoto, Shosuke (JP)	1990-09-04	—	—	US	disclosed