SCHEMBL4848447

SCHEMBL4848447

NCC(=O)NCC1CCN(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 6/20 0.66
FAAH O00519 5/20 0.66
ACHE P22303 5/20 0.66
BCHE P06276 3/20 0.66
KCNH2 Q12809 1/20 0.56
CACNA1I Q9P0X4 1/20 0.56
HDAC3 O15379 2/20 0.54
HDAC4 P56524 2/20 0.54
HDAC1 Q13547 2/20 0.54
HDAC7 Q8WUI4 2/20 0.54
HDAC2 Q92769 2/20 0.54
HDAC10 Q969S8 2/20 0.54
HDAC11 Q96DB2 2/20 0.54
HDAC8 Q9BY41 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
HDAC9 Q9UKV0 2/20 0.54
HDAC5 Q9UQL6 2/20 0.54
TP53 P04637 1/20 0.53
SIGMAR1 Q99720 1/20 0.52

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 SCHEMBL4847979 0.99 CCR2 (0.65) CCR2FAAHACHEBCHEKCNH2
SCHEMBL4840961 0.92 TP53 (0.62) CCR2FAAHACHEBCHEKCNH2
SCHEMBL4845806 0.88 ACHE (0.56) CCR2FAAHACHEBCHEKCNH2
SCHEMBL4850053 0.88 FAAH (0.56) CCR2FAAHACHEBCHEHDAC3
SCHEMBL4848290 0.85 GAA (0.57) CCR2FAAHACHEBCHETP53
SCHEMBL4843068 0.85 SIGMAR1 (0.56) CCR2FAAHACHEBCHEKCNH2
SCHEMBL3593316 0.85 CCR2 (0.67) CCR2FAAHACHEBCHEKCNH2
SCHEMBL27558611 0.84 CCR2 (0.62) CCR2FAAHACHEBCHEKCNH2
Hydrochloric Acid SCHEMBL3592266 0.84 CCR2 (0.65) CCR2FAAHACHEBCHEKCNH2
SCHEMBL4844658 0.83 NPFFR2 (0.56) CCR2FAAHACHEBCHEKCNH2

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 8 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
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