SCHEMBL28543716

SCHEMBL28543716

CC(=NC(=NO)c1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 11/20 0.50
CES1 P23141 10/20 0.50
GAA P10253 1/20 0.40
CYP2C19 P33261 1/20 0.40
MAPT P10636 3/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 1/20 0.39
XBP1 P17861 1/20 0.39
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
EGFR P00533 1/20 0.39
CYP1A2 P05177 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
SCHEMBL1049892 0.82 CES2 (0.60) CES2CES1GAACYP2C19MAPT
SCHEMBL449946 0.82 CES2 (0.60) CES2CES1GAACYP2C19MAPT
SCHEMBL108031 0.82 CES2 (0.60) CES2CES1GAACYP2C19MAPT
SCHEMBL28138711 0.82 CES2 (0.60) CES2CES1GAACYP2C19MAPT
SCHEMBL17122194 0.74 CES2 (0.60) CES2CES1MAPTRAB9AKDM4E
SCHEMBL19932743 0.74 CES2 (0.60) CES2CES1MAPTRAB9AKDM4E
SCHEMBL12424045 0.74 CES2 (0.60) CES2CES1MAPTRAB9AKDM4E
SCHEMBL11424490 0.73 CES2 (0.54) CES2CES1GAACYP2C19MAPT
SCHEMBL7808020 0.72 CES2 (0.58) CES2CES1CYP2C19MAPTRAB9A
SCHEMBL13069013 0.72 CES2 (0.58) CES2CES1CYP2C19MAPTRAB9A

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
CN-112368641-A Photosensitive resin composition, photosensitive sheet, cured film of photosensitive resin composition and photosensitive sheet, method for producing cured film, and electronic component 东丽株式会社 2021-02-12 CN disclosed