SCHEMBL6205049

SCHEMBL6205049

NCC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 13/20 0.72
TEAD1 P28347 1/20 0.66
LMNA P02545 1/20 0.57
DRD4 P21917 2/20 0.57
POLB P06746 1/20 0.56

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
SCHEMBL4426833 0.92 CCR2 (0.65) SIGMAR1TEAD1DRD4
SCHEMBL4846218 0.92 CCR2 (0.65) SIGMAR1TEAD1DRD4
SCHEMBL4426840 0.92 CCR2 (0.65) SIGMAR1TEAD1DRD4
SCHEMBL4844753 0.87 SIGMAR1 (0.79) SIGMAR1POLB
Hydrochloric Acid SCHEMBL31462260 0.86 SIGMAR1 (0.77) SIGMAR1POLB
SCHEMBL3590338 0.84 SIGMAR1 (0.73) SIGMAR1TEAD1LMNADRD4POLB
SCHEMBL4214471 0.83 TEAD1 (0.73) SIGMAR1TEAD1LMNADRD4POLB
SCHEMBL4847367 0.82 CCR2 (0.71) SIGMAR1DRD4
SCHEMBL4844836 0.82 CCR2 (0.71) SIGMAR1DRD4
SCHEMBL4848447 0.81 CCR2 (0.66) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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