SCHEMBL19683169

SCHEMBL19683169

CCCCC[C@@H]1NC(=O)[C@H](C)N1C

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
HPGD P15428 1/20 0.37
PRKCD Q05655 8/20 0.35
HLCS P50747 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ABL1 P00519 2/20 0.33
RIN1 Q13671 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
GAA P10253 2/20 0.33
TNF P01375 1/20 0.33
DAGLA Q9Y4D2 1/20 0.32
FUCA1 P04066 1/20 0.32
MGLL Q99685 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL19683168 0.80 HLCS (0.38) HLCS
SCHEMBL8029692 0.70 MMP1 (0.38) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL8029695 0.70 MMP1 (0.38) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL12952341 0.69 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL20227811 0.69 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL12326338 0.69 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL7546526 0.69 GAA (0.38) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL5452034 0.68
SCHEMBL624404 0.66 ALDH1A1 (0.55) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL5442521 0.66 ALDH1A1 (0.45) ALDH1A1MEN1KMT2AKDM4EMAPT

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
WO-2017210489-A1 COMPOUNDS M3 BIOTECHNOLOGY, INC. (US) 2017-12-07 WO disclosed