SCHEMBL28295752

SCHEMBL28295752

CCCCCC(CC)Oc1ccccc1C(=O)[SiH2]c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 1/20 0.44
RECQL P46063 1/20 0.44
PRSS1 P07477 2/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
ALDH1A1 P00352 3/20 0.41
NPSR1 Q6W5P4 1/20 0.39
CYP3A4 P08684 3/20 0.39
LMNA P02545 2/20 0.39
NR1I2 O75469 1/20 0.39
CHRM2 P08172 1/20 0.39
ADRA2A P08913 1/20 0.39
MAPT P10636 1/20 0.39
OPRK1 P41145 1/20 0.39
HTR2B P41595 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
CA2 P00918 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
SCHEMBL28293914 0.85 PRSS1 (0.43) MEN1KMT2AKDM4ERECQLPRSS1
SCHEMBL342808 0.84 KDM4E (0.57) MEN1KMT2AKDM4ERECQLPRSS1
SCHEMBL28293906 0.84 PRSS1 (0.42) MEN1KMT2AKDM4ERECQLPRSS1
SCHEMBL11564477 0.83 KDM4E (0.56) MEN1KMT2AKDM4ERECQLPRSS1
SCHEMBL9324896 0.83 KDM4E (0.56) MEN1KMT2AKDM4ERECQLPRSS1
SCHEMBL28293905 0.82 PRSS1 (0.41) MEN1KMT2AKDM4ERECQLPRSS1
SCHEMBL28293912 0.82 PRSS1 (0.47) MEN1KMT2AKDM4ERECQLPRSS1
SCHEMBL20981436 0.81 PRSS1 (0.38) MEN1KMT2AKDM4ERECQLPRSS1
SCHEMBL27641227 0.79 KDM4E (0.57) MEN1KMT2AKDM4ERECQLPRSS1
SCHEMBL28658873 0.79 PRSS1 (0.53) MEN1KMT2AKDM4ERECQLPRSS1

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
CN-109790190-A Curing agent for silicone rubber material 硝基化学阿绍有限公司 2019-05-21 CN claimed
CN-109790190-A Curing agent for silicone rubber material 硝基化学阿绍有限公司 2019-05-21 CN disclosed