SCHEMBL31056336

SCHEMBL31056336

O=Cc1cc(C(=O)OCc2ccccc2)cc(Cl)c1OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A3 Q01959 1/20 0.50
KDM4E B2RXH2 1/20 0.48
LMNA P02545 5/20 0.47
HPGD P15428 2/20 0.47
POLB P06746 1/20 0.46
ALDH1A1 P00352 3/20 0.42
RAB9A P51151 3/20 0.42
MAPT P10636 2/20 0.42
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GLRA1 P23415 1/20 0.41
GAA P10253 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41

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
SCHEMBL28857697 0.88 KMT2A (0.60) KMT2ATDP1SLC6A2SLC6A3KDM4E
SCHEMBL3229895 0.80 KDM4E (0.60) KMT2ATDP1SLC6A2SLC6A3KDM4E
SCHEMBL7812691 0.80 LMNA (0.59) KMT2AKDM4ELMNAALDH1A1MAPT
SCHEMBL4241842 0.79 KDM4E (0.62) KMT2ATDP1SLC6A2SLC6A3KDM4E
SCHEMBL31056249 0.78 KMT2A (0.45) KMT2ATDP1SLC6A2SLC6A3KDM4E
SCHEMBL28743422 0.78 LMNA (0.48) KMT2AKDM4ELMNAHPGDPOLB
SCHEMBL8506243 0.77 TDP1 (0.52) KMT2ATDP1ALDH1A1MAPTMRGPRX4
SCHEMBL7398752 0.77 HTR1A (0.50) KMT2ALMNAHPGDPOLBALDH1A1
SCHEMBL1458413 0.76 LMNA (0.74) KMT2AKDM4ELMNAHPGDALDH1A1
SCHEMBL20402661 0.76 TDP1 (0.62) KMT2ATDP1SLC6A2SLC6A3KDM4E

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