SCHEMBL9828272

SCHEMBL9828272

[CH2]C(=N)N1CCN(C)C(=O)C1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 5/20 0.42
PIK3CD O00329 1/20 0.39
DPP4 P27487 1/20 0.36
BRD4 O60885 1/20 0.35
BRD2 P25440 1/20 0.35
CECR2 Q9BXF3 1/20 0.33
NOTUM Q6P988 2/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL29033709 0.80 P2RX7 (0.42) P2RX7PIK3CDDPP4BRD4BRD2
SCHEMBL9829476 0.78 MAPK1 (0.31)
SCHEMBL24711921 0.78 P2RX7 (0.43) P2RX7PIK3CDDPP4BRD4BRD2
SCHEMBL9829835 0.77
SCHEMBL9828335 0.76 NOTUM (0.35) NOTUM
SCHEMBL5508211 0.75 P2RX7 (0.47) P2RX7PIK3CDDPP4BRD4BRD2
SCHEMBL10274994 0.75 CYP1A2 (0.48) P2RX7PIK3CDDPP4BRD4BRD2
SCHEMBL23583854 0.74 P2RX7 (0.44) P2RX7PIK3CDDPP4
Hydrochloric Acid SCHEMBL9836222 0.74 P2RX7 (0.41) P2RX7PIK3CDDPP4BRD4BRD2
Hydrochloric Acid SCHEMBL9835431 0.74 PIK3CD (0.39) P2RX7PIK3CDDPP4BRD4BRD2

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-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP claimed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US claimed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP claimed
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed