SCHEMBL31258375

SCHEMBL31258375

CC(C)(C)OC(=O)C(C)(C)Oc1cccc(N2CCCCC2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.41
DRD2 P14416 6/20 0.40
KMT2A Q03164 4/20 0.39
GAA P10253 3/20 0.39
HTT P42858 1/20 0.38
DRD3 P35462 1/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 3/20 0.37
ATM Q13315 2/20 0.37
MAPK1 P28482 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
POLB P06746 2/20 0.37
NPC1 O15118 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL31258388 0.76 MRGPRX4 (0.39) KMT2AHTTDRD3MAPTKDM4E
SCHEMBL31258404 0.75 FFAR4 (0.42) KMT2AGAADRD3KDM4EMEN1
SCHEMBL24873121 0.74 ALDH1A1 (0.44) KMT2AGAAMAPTKDM4EMEN1
SCHEMBL24872963 0.71 ATM (0.41) DRD2KMT2AGAAHTTDRD3
SCHEMBL11224008 0.69 RBP4 (0.42) DRD2KMT2AGAADRD3MAPT
SCHEMBL20516442 0.68 MEN1 (0.56) KMT2AMAPTMEN1POLBLMNA
SCHEMBL253634 0.68 MEN1 (0.55) NOX1DRD2KMT2ADRD3MAPT
SCHEMBL6916048 0.67 NPC1 (0.59) KMT2AGAAHTTMAPTMEN1
SCHEMBL7271339 0.66 ALDH1A1 (0.48) DRD2KMT2AGAADRD3NPC1
SCHEMBL246696 0.66 DRD2 (0.56) DRD2KMT2ADRD3MAPTMEN1

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
US-20240391896-A1 SMALL MOLECULE COMPOUND TARGETING BCL9/BETA-CATENIN INTERACTION Nantong Jutai Biotech Co., Ltd. (CN) 2024-11-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240391896-A1 SMALL MOLECULE COMPOUND TARGETING BCL9/BETA-CATENIN INTERACTION BCL9, BCL9L, BCL2L11 NOX1 3419/4885DRD2 2921/4885KMT2A 3657/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.