SCHEMBL7351663

SCHEMBL7351663

O=C(O)NN=C1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.53
ALDH1A1 P00352 3/20 0.53
KMT2A Q03164 2/20 0.53
RAB9A P51151 1/20 0.53
RXFP1 Q9HBX9 1/20 0.52
POLB P06746 2/20 0.50
OGG1 O15527 1/20 0.50
GAA P10253 1/20 0.50
CTDSP1 Q9GZU7 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL7354510 0.98 KDM4E (0.50) KDM4EALDH1A1KMT2ARAB9ARXFP1
SCHEMBL7345401 0.93
SCHEMBL80049 0.83 KDM4E (0.71) KDM4EALDH1A1KMT2ARAB9ARXFP1
SCHEMBL9356896 0.79 KDM4E (0.52) KDM4EALDH1A1KMT2ARAB9ARXFP1
SCHEMBL3489240 0.77 ALDH1A1 (0.38) KDM4EALDH1A1KMT2ARAB9APOLB
SCHEMBL9356593 0.76 KDM4E (0.48) KDM4EALDH1A1KMT2ARAB9ARXFP1
SCHEMBL20621742 0.74 KDM4E (0.73) KDM4EALDH1A1POLBOGG1GAA
SCHEMBL20621709 0.74 KDM4E (0.73) KDM4EALDH1A1POLBOGG1GAA
SCHEMBL23906444 0.74 LMNA (0.36) KDM4EALDH1A1KMT2ARAB9ARXFP1
SCHEMBL20583677 0.74 KDM4E (0.38) KDM4EALDH1A1KMT2ARAB9ARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5541187-A HYPOTENSIVE AGENTS STERLING WINTHROP INC. (US) 1996-07-30 US disclosed
US-5294612-A Hypotensive agents and cardiovascular disorders STERLING WINTHROP INC. (US) 1994-03-15 US disclosed