SCHEMBL8673288

SCHEMBL8673288

[CH2]Oc1cc(CCCC)nc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4E B2RXH2 3/20 0.47
PARP1 P09874 1/20 0.43
LMNA P02545 2/20 0.43
CYP1A2 P05177 2/20 0.43
ABCB11 O95342 1/20 0.43
CYP2D6 P10635 1/20 0.43
SCN1A P35498 1/20 0.43
SCN2A Q99250 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SCN3A Q9NY46 1/20 0.43
HPGD P15428 2/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
DHODH Q02127 1/20 0.42
TLR8 Q9NR97 1/20 0.42
PDE10A Q9Y233 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
NCF1 P14598 1/20 0.41

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
SCHEMBL31587740 0.87 LMNA (0.56) MEN1KMT2AKDM4EPARP1LMNA
SCHEMBL7848611 0.86 MEN1 (0.46) MEN1KMT2AKDM4EPARP1LMNA
SCHEMBL3972659 0.84 AGTR1 (0.45) KDM4ELMNAHPGDALDH1A1GAA
SCHEMBL951984 0.82 LMNA (0.55) MEN1KMT2AKDM4ELMNAHPGD
SCHEMBL8410524 0.81 MEN1 (0.43) MEN1KMT2AKDM4EPARP1LMNA
SCHEMBL8671748 0.80 MEN1 (0.51) MEN1KMT2AKDM4EPARP1LMNA
SCHEMBL9179529 0.80 MEN1 (0.53) MEN1KMT2AKDM4EPARP1LMNA
SCHEMBL8412379 0.79 AGTR1 (0.48) MEN1KMT2AKDM4ELMNACYP1A2
SCHEMBL8673292 0.78 KDM4E (0.55) MEN1KMT2AKDM4EPARP1LMNA
SCHEMBL8671753 0.78 CYP1A2 (0.53) MEN1KMT2AKDM4EPARP1CYP1A2

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-5817674-A ANTIOTENSIN II RECEPTOR ANTAGONISTS ROUSSEL UCLAF (FR) 1998-10-06 US disclosed