SCHEMBL365134

SCHEMBL365134

N#Cc1c2ccccc2n2cc(OC(=O)N3CCOCC3)ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
RAB9A P51151 2/20 0.50
KDM4E B2RXH2 2/20 0.50
NPC1 O15118 1/20 0.50
MEN1 O00255 4/20 0.48
CASP3 P42574 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 2/20 0.45
EPHX1 P07099 2/20 0.45
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 1/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL365133 0.83 KMT2A (0.57) KMT2ASMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL365668 0.82 KMT2A (0.55) KMT2ASMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL365101 0.81 KMT2A (0.51) KMT2ASMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL365016 0.77 KDM4E (0.50) KMT2ASMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL365640 0.76 KMT2A (0.43) KMT2ARAB9AKDM4ENPC1MEN1
SCHEMBL366561 0.75 KMT2A (0.45) KMT2ASMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL366922 0.72 L3MBTL1 (0.62) KMT2ASMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL367737 0.71 L3MBTL1 (0.45) KMT2ASMN1; SMN2KDM4EMEN1CASP3
SCHEMBL366310 0.70 ALDH1A1 (0.52) KMT2ASMN1; SMN2RAB9AKDM4EMEN1
SCHEMBL367409 0.70 EPHX1 (0.48) KMT2ASMN1; SMN2RAB9AKDM4ENPC1

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
WO-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed