SCHEMBL19230422

SCHEMBL19230422

CN1C(=O)C(=O)c2c1ccc1ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.47
TTR P02766 1/20 0.47
DNMT1 P26358 1/20 0.44
MAPT P10636 5/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 2/20 0.40
CASP3 P42574 3/20 0.40
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
PKM P14618 1/20 0.39
PAX8 Q06710 1/20 0.38
CYP2A6 P11509 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
WDR5 P61964 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL19230397 0.92 HPRT1 (0.45) CES1TTRDNMT1MAPTMEN1
SCHEMBL19230395 0.85 CES1 (0.43) CES1TTRCASP3ALDH1A1PKM
SCHEMBL20414449 0.79 CES1 (0.47) CES1DNMT1MAPTMEN1KMT2A
SCHEMBL12775946 0.76 MAPT (0.47) DNMT1MAPTMEN1KMT2AKDM4E
SCHEMBL8603564 0.76 ALDH1A1 (0.57) CES1ALDH1A1
SCHEMBL2604372 0.75 MAPT (0.41) CES1DNMT1MAPTMEN1KMT2A
SCHEMBL4109839 0.73 DNMT1 (0.50) DNMT1MAPTMEN1KMT2AKDM4E
SCHEMBL9180379 0.71 ALDH1A1 (0.51) CES1TTRDNMT1MAPTMEN1
SCHEMBL12776299 0.70 DNMT1 (0.43) CES1TTRDNMT1MAPTMEN1
SCHEMBL2578936 0.69 ALDH1A1 (0.48) MAPTMEN1KMT2AKDM4EALDH1A1

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-2017137142-A1 A POLYMER, COMPOSITION, FORMING SACRIFICIAL LAYER AND METHOD FOR SEMICONDUCTOR DEVICE THEREWITH AZ Electronic Materials (Luxembourg) S.à.r.l. (LU) 2017-08-17 WO disclosed