SCHEMBL4849913

SCHEMBL4849913

NC1CCN(Cc2ccc(Br)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.54
ACHE P22303 2/20 0.54
BACE1 P56817 2/20 0.54
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
CCR5 P51681 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SIGMAR1 Q99720 2/20 0.45
OPRM1 P35372 2/20 0.44
KDM1A O60341 1/20 0.44
LTA4H P09960 1/20 0.43
DRD4 P21917 1/20 0.43
CDC7 O00311 2/20 0.43
PIM1 P11309 2/20 0.43
CSNK2A2 P19784 2/20 0.43
CSNK2B P67870 2/20 0.43
CSNK2A1 P68400 2/20 0.43
PIM3 Q86V86 2/20 0.43
PIM2 Q9P1W9 2/20 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL4849908 1.00 BCHE (0.54) BCHEACHEBACE1KDM4EALDH1A1
SCHEMBL3141955 0.89 KDM4E (0.58) BCHEACHEBACE1KDM4EALDH1A1
SCHEMBL17450392 0.84 ALDH1A1 (0.55) BCHEACHEBACE1ALDH1A1SIGMAR1
SCHEMBL3810502 0.84 GAA (0.54) BCHEACHEBACE1KDM4EALDH1A1
SCHEMBL4427076 0.84 GAA (0.54) BCHEACHEBACE1KDM4EALDH1A1
SCHEMBL3810424 0.84 GAA (0.54) BCHEACHEBACE1KDM4EALDH1A1
SCHEMBL578345 0.84 BCHE (0.55) BCHEACHEBACE1KDM4EALDH1A1
SCHEMBL578344 0.84 BCHE (0.55) BCHEACHEBACE1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL4427412 0.83 GAA (0.52) BCHEACHEBACE1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL4432892 0.83 GAA (0.52) BCHEACHEBACE1KDM4EALDH1A1

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 9 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
EP-1179341-B1 REMEDIES OR PREVENTIVES FOR DISEASES IN ASSOCIATION WITH CHEMOKINES TEIJIN LTD (JP) 2005-11-09 EP disclosed
EP-1553085-A1 Cyclic amine derivatives and their use as drugs TEIJIN LIMITED (JP) 2005-07-13 EP disclosed
EP-1535909-A2 Cyclic amine derivatives and their use as drugs TEIJIN LIMITED (JP) 2005-06-01 EP disclosed
CN-1384743-A Remedies or preventives for diseases in association with chemokines TEIJIN LTD (JP) 2002-12-11 CN disclosed
US-6451842-B1 Cyclic amine derivatives and their use as drugs DUPONT PHARMACEUTICALS COMPANY 2002-09-17 US disclosed
US-6410566-B1 ATHEROSCLEROSIS; ANTIARTHRITIC AGENTS TEIJIN LIMITED (JP) 2002-06-25 US disclosed
US-6362177-B1 INHIBITION OF CHEMOKINE BINDING TEIJIN LIMITED (JP) 2002-03-26 US disclosed
EP-1179341-A1 REMEDIES OR PREVENTIVES FOR DISEASES IN ASSOCIATION WITH CHEMOKINES TEIJIN LIMITED (JP) 2002-02-13 EP disclosed