SCHEMBL4846613

SCHEMBL4846613

CNCC1CCN(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.76
CXCR4 P61073 4/20 0.62
ALDH1A1 P00352 2/20 0.59
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
CCR2 P41597 2/20 0.52
KDM4E B2RXH2 1/20 0.51
BCHE P06276 1/20 0.51
ACHE P22303 1/20 0.51
BACE1 P56817 1/20 0.51
KCNH2 Q12809 1/20 0.51
CACNA1I Q9P0X4 1/20 0.51
CXCR3 P49682 1/20 0.50

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
SCHEMBL27269515 0.87 L3MBTL1 (0.58) L3MBTL1CXCR4ALDH1A1ACHEBACE1
SCHEMBL23945299 0.86 L3MBTL1 (0.58) L3MBTL1CXCR4ALDH1A1BCHEACHE
SCHEMBL6215695 0.85 CXCR4 (0.74) L3MBTL1CXCR4ALDH1A1BCHEACHE
SCHEMBL21820699 0.81 ALDH1A1 (0.64) L3MBTL1CXCR4ALDH1A1MEN1KMT2A
SCHEMBL20710409 0.81 KDM1A (0.62) L3MBTL1CXCR4MEN1KMT2AKCNH2
SCHEMBL27558611 0.81 CCR2 (0.62) CXCR4CCR2BCHEACHEKCNH2
SCHEMBL22775689 0.80 CXCR4 (0.55) L3MBTL1CXCR4ALDH1A1MEN1KMT2A
SCHEMBL13202572 0.80 MEN1 (0.61) ALDH1A1MEN1KMT2AKDM4EBCHE
SCHEMBL23806785 0.80 L3MBTL1 (0.51) L3MBTL1CXCR4ALDH1A1MEN1KMT2A
SCHEMBL3593316 0.79 CCR2 (0.67) CXCR4ALDH1A1CCR2BCHEACHE

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