SCHEMBL28080270

SCHEMBL28080270

CCN(CC)CCCNC(=O)c1cnccn1

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.70
KMT2A Q03164 6/20 0.57
LMNA P02545 1/20 0.54
HPGD P15428 1/20 0.54
MEN1 O00255 3/20 0.52
POLB P06746 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.50

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
SCHEMBL30372557 0.85 KDM4E (0.69) KDM4EKMT2ALMNAHPGDMEN1
SCHEMBL6359528 0.85 KDM4E (0.88) KDM4EKMT2ALMNAHPGDMEN1
SCHEMBL9755022 0.84 KDM4E (0.97) KDM4EKMT2ALMNAHPGDMEN1
SCHEMBL7724527 0.84 KDM4E (0.58) KDM4EKMT2ALMNAHPGDMEN1
SCHEMBL3924178 0.82 KDM4E (1.00) KDM4EKMT2ALMNAHPGDMEN1
SCHEMBL18896226 0.82 KDM4E (1.00) KDM4EKMT2ALMNAHPGDMEN1
SCHEMBL20152243 0.82 KDM4E (1.00) KDM4EKMT2ALMNAHPGDMEN1
SCHEMBL3614618 0.82 KDM4E (1.00) KDM4EKMT2ALMNAHPGDMEN1
SCHEMBL26922312 0.82 KDM4E (0.68) KDM4EKMT2ALMNAHPGDMEN1
SCHEMBL6360168 0.82 KDM4E (0.77) KDM4EKMT2ALMNAHPGDMEN1

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
CN-104903293-B Novel anti-invasive compounds ABIVAX公司 2016-08-24 CN disclosed