SCHEMBL14256358

CCCCN(CCCC)c1nc(N(CCCC)CCCC)nc(N(CCCCCCCCN(c2nc(N(CCCC)C3CC(C)(C)NC(C)(C)C3)nc(N(CCCCCCCCN(c3nc(N(CCCC)CCCC)nc(N(CCCC)CCCC)n3)C3CC(C)(C)NC(C)(C)C3)C3CC(C)(C)NC(C)(C)C3)n2)C2CC(C)(C)NC(C)(C)C2)C2CC(C)(C)NC(C)(C)C2)n1

nearest known ligand 0.33

Predicted protein targets (top 1)

	gene	UniProt	supporting neighbours	confidence
▸	CRHR1	P34998	2/20	0.33

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
SCHEMBL10325634	1.00	CRHR1 (0.33)	CRHR1
SCHEMBL13297996	0.99	CRHR1 (0.32)	CRHR1
SCHEMBL16253396	0.99	CRHR1 (0.32)	CRHR1
SCHEMBL9575336	0.99	CRHR1 (0.32)	CRHR1
SCHEMBL10000503	0.97	CRHR1 (0.33)	CRHR1
SCHEMBL3141109	0.97	CRHR1 (0.34)	CRHR1
SCHEMBL11997811	0.95	CRHR1 (0.40)	CRHR1
SCHEMBL11997810	0.95	CRHR1 (0.30)	CRHR1
SCHEMBL12100506	0.94	—	—
SCHEMBL17429227	0.94	CRHR1 (0.30)	CRHR1

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-20080074480-A1	INK COMPOSITION, INKJET RECORDING METHOD, AND PRINTED MATERIAL	FUJIFILM CORPORATION (JP)	2008-03-27	—	—	US	disclosed