SCHEMBL7330876

SCHEMBL7330876

CC1CCN(C(=O)[C@@H](N)CCCNc2ncccn2)CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 8/20 0.44
DPP4 P27487 2/20 0.44
F2 P00734 4/20 0.43
GRIN2B Q13224 4/20 0.42
OGA O60502 2/20 0.39
TLR9 Q9NR96 1/20 0.38
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
HPGD P15428 1/20 0.37

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
SCHEMBL7330894 1.00 DPP7 (0.44) DPP7DPP4F2GRIN2BOGA
SCHEMBL7331189 0.87 F2 (0.56) DPP7DPP4F2GRIN2BDPP8
SCHEMBL9054640 0.82 ITGB3 (0.42) DPP7DPP4F2TLR9TLR8
SCHEMBL7336551 0.82 F2 (0.41) DPP4F2GRIN2BOGAHPGD
SCHEMBL7331176 0.81 F2 (0.61) DPP7DPP4F2TLR9TLR8
SCHEMBL7331163 0.81 F2 (0.61) DPP7DPP4F2TLR9TLR8
SCHEMBL7309345 0.77 DPP7 (0.43) DPP7DPP4OGADPP8DPP9
SCHEMBL7309335 0.77 DPP7 (0.43) DPP7DPP4OGADPP8DPP9
SCHEMBL2859755 0.76 DPP4 (0.58) DPP7DPP4DPP8DPP9
SCHEMBL2859760 0.76 DPP4 (0.58) DPP7DPP4DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5371091-A Anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 1994-12-06 US disclosed