SCHEMBL6206813

SCHEMBL6206813

NC(COCc1ccccc1)C(=O)NCC1CCN(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPFFR2 Q9Y5X5 1/20 0.58
ACHE P22303 6/20 0.57
BCHE P06276 5/20 0.57
FAAH O00519 4/20 0.57
CCR2 P41597 3/20 0.55
ALDH1A1 P00352 1/20 0.52
DRD2 P14416 1/20 0.49
DRD4 P21917 1/20 0.49
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HDAC9 Q9UKV0 1/20 0.49
HDAC5 Q9UQL6 1/20 0.49
SOS1 Q07889 1/20 0.49

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
SCHEMBL4847821 1.00 NPFFR2 (0.58) NPFFR2ACHEBCHEFAAHCCR2
SCHEMBL4848526 0.85 NPFFR2 (0.52) NPFFR2ACHEBCHEFAAHCCR2
SCHEMBL4848529 0.85 NPFFR2 (0.52) NPFFR2ACHEBCHEFAAHCCR2
SCHEMBL4844669 0.82 NPFFR2 (0.56) NPFFR2ACHEBCHEFAAHCCR2
SCHEMBL4844658 0.82 NPFFR2 (0.56) NPFFR2ACHEBCHEFAAHCCR2
SCHEMBL18017138 0.82 NPFFR2 (0.70) NPFFR2ACHEBCHEFAAHHDAC3
SCHEMBL6205154 0.80 CCR2 (0.55) NPFFR2ACHEBCHEFAAHCCR2
SCHEMBL4850685 0.79 CCR2 (0.53) NPFFR2ACHEBCHEFAAHCCR2
SCHEMBL4850691 0.79 CCR2 (0.53) NPFFR2ACHEBCHEFAAHCCR2
SCHEMBL4840720 0.79 CCR2 (0.56) NPFFR2ACHEBCHEFAAHCCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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