SCHEMBL7357348

SCHEMBL7357348

COCOC1CCN(C(N)=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.38
PDE4B Q07343 3/20 0.35
ITGB3 P05106 3/20 0.34
ITGA2B P08514 3/20 0.34
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
CHRM1 P11229 1/20 0.33
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
CYP11B2 P19099 1/20 0.32
REN P00797 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL24158834 0.84 KMT2A (0.41) GAAPDE4BITGB3ITGA2BKMT2A
SCHEMBL9387116 0.82 KMT2A (0.32) GAAKMT2ASMN1; SMN2RENALDH1A1
SCHEMBL3435947 0.81 GAA (0.47) GAAITGB3ITGA2BNOS3NOS2
SCHEMBL9835380 0.81 NPC1 (0.46) CHRM1KMT2A
SCHEMBL10140462 0.79 ITGB3 (0.34) GAAITGB3ITGA2BCHRM1
SCHEMBL356124 0.79 ITGB3 (0.34) GAAITGB3ITGA2BCHRM1
SCHEMBL1700940 0.79 KMT2A (0.40) GAAPDE4BNOS3NOS2KMT2A
SCHEMBL23581416 0.79 GAA (0.41) GAAITGB3ITGA2BNOS3NOS2
SCHEMBL9442983 0.78 REN (0.38) ITGB3ITGA2BKMT2ARENALDH1A1
SCHEMBL9442985 0.78 REN (0.38) ITGB3ITGA2BKMT2ARENALDH1A1

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
US-5389647-A A prodrugs as hypotensive agents, treating congestive heart failure, urogenital disorders, vision defects ABBOTT LABORATORIES (US) 1995-02-14 US disclosed
US-5244910-A Treating hypertension, congestive heart failure ABBOTT LABORATORIES (US) 1993-09-14 US disclosed
EP-0543936-A4 RENIN INHIBITORS 1993-06-30 EP disclosed
EP-0543936-A1 RENIN INHIBITORS ABBOTT LABORATORIES (US) 1993-06-02 EP disclosed
WO-1992003429-A1 RENIN INHIBITORS ABBOTT LABORATORIES (US) 1992-03-05 WO disclosed