SCHEMBL31056249

SCHEMBL31056249

O=C(OCc1ccccc1)c1cc(Cl)c(OCc2ccccc2)c(C2OCCO2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KDM4E B2RXH2 3/20 0.44
LMNA P02545 4/20 0.43
HPGD P15428 2/20 0.43
FABP4 P15090 1/20 0.40
POLB P06746 1/20 0.39
ALDH1A1 P00352 4/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 2/20 0.39
GLRA1 P23415 1/20 0.38
MEN1 O00255 1/20 0.38
OPRK1 P41145 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
S1PR1 P21453 1/20 0.38
PRKX P51817 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
SCHEMBL31056479 0.90 MEN1 (0.47) KMT2AKDM4EHPGDFABP4ALDH1A1
SCHEMBL28857697 0.83 KMT2A (0.60) KMT2ATDP1SLC6A2SLC6A3KDM4E
SCHEMBL31056336 0.78 KMT2A (0.50) KMT2ATDP1SLC6A2SLC6A3KDM4E
SCHEMBL31056582 0.77 LMNA (0.56) KMT2ALMNAHPGDALDH1A1NPC1
SCHEMBL31055907 0.77 LMNA (0.56) KMT2AKDM4ELMNAHPGDALDH1A1
SCHEMBL31055861 0.76 MEN1 (0.47) KMT2ASLC6A2SLC6A3LMNAHPGD
SCHEMBL3229895 0.75 KDM4E (0.60) KMT2ATDP1SLC6A2SLC6A3KDM4E
SCHEMBL4241842 0.74 KDM4E (0.62) KMT2ATDP1SLC6A2SLC6A3KDM4E
SCHEMBL31056523 0.74 HPGD (0.53) KMT2AKDM4ELMNAHPGDALDH1A1
SCHEMBL31056278 0.74 MRGPRX4 (0.47) KMT2ATDP1LMNAHPGDPOLB

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-2024178390-A1 COVALENT MODIFIERS OF AKT1 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. (US) 2024-08-29 WO disclosed