SCHEMBL7978080

SCHEMBL7978080

CCC(=O)NC(=N)NC(=N)NNC(=N)NC(=N)NC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
PKM P14618 1/20 0.31
UBE2N P61088 1/20 0.30
POLB P06746 1/20 0.30
NR4A1 P22736 1/20 0.30
RAB9A P51151 1/20 0.30
CRBN Q96SW2 1/20 0.30

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
SCHEMBL1071241 0.82 MEN1 (0.42) KMT2AKDM4EMAPTMEN1ALDH1A1
SCHEMBL98447 0.75
SCHEMBL1070826 0.75 CRBN (0.47) KDM4EALDH1A1CRBN
Ethane SCHEMBL27485860 0.73 ALDH1A1 (0.42) KMT2AKDM4EMAPTMEN1ALDH1A1
SCHEMBL17919017 0.72
SCHEMBL3076742 0.71
SCHEMBL14907230 0.69 HDAC3 (0.39) KMT2AKDM4EMAPTCRBN
SCHEMBL16590589 0.69 KMT2A (0.39) KMT2AKDM4EMAPTMEN1ALDH1A1
SCHEMBL17919096 0.67
SCHEMBL5848756 0.67 MEN1 (0.39) KMT2AMEN1ALDH1A1SMN1; SMN2

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-6271178-B1 APPLYING TO PLANTS; CONTROLLING WEEDS BAYER AG (DE) 2001-08-07 US disclosed