SCHEMBL4844753

SCHEMBL4844753

NCC(=O)NC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 18/20 0.79
POLB P06746 1/20 0.72
L3MBTL1 Q9Y468 1/20 0.68

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.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL31462260 0.99 SIGMAR1 (0.77) SIGMAR1POLBL3MBTL1
Hydrochloric Acid SCHEMBL31462269 0.91 SIGMAR1 (0.65) SIGMAR1POLB
SCHEMBL4848450 0.90 SIGMAR1 (0.77) SIGMAR1POLBL3MBTL1
SCHEMBL5862113 0.88 SIGMAR1 (1.00) SIGMAR1
SCHEMBL6205049 0.87 SIGMAR1 (0.72) SIGMAR1POLB
SCHEMBL6750438 0.87 SIGMAR1 (0.77) SIGMAR1POLBL3MBTL1
SCHEMBL3075354 0.87 SIGMAR1 (0.81) SIGMAR1POLBL3MBTL1
SCHEMBL5124505 0.87 SIGMAR1 (0.81) SIGMAR1POLBL3MBTL1
SCHEMBL29640480 0.87 SIGMAR1 (0.81) SIGMAR1POLBL3MBTL1
SCHEMBL7268908 0.86 SIGMAR1 (0.79) SIGMAR1POLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7390830-B1 Remedies or prophylactics for diseases in association with chemokines TEIJIN LIMITED (JP) 2008-06-24 US disclosed
CN-1240699-C Therapeutic or prophylactic agent for chemokine-associated diseases TEIJIN LTD (JP) 2006-02-08 CN disclosed
EP-1179341-B1 REMEDIES OR PREVENTIVES FOR DISEASES IN ASSOCIATION WITH CHEMOKINES TEIJIN LTD (JP) 2005-11-09 EP disclosed
EP-1179341-A1 REMEDIES OR PREVENTIVES FOR DISEASES IN ASSOCIATION WITH CHEMOKINES TEIJIN LIMITED (JP) 2002-02-13 EP disclosed