SCHEMBL23957953

SCHEMBL23957953

CC(C)(C)c1cn(C(C)(C)C)c(=O)c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 7/20 0.37
ELANE P08246 2/20 0.36
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PMM2 O15305 1/20 0.34
MPI P34949 1/20 0.34
PHOSPHO1 Q8TCT1 1/20 0.34
PRKDC P78527 1/20 0.34
PGR P06401 1/20 0.33
RORA P35398 1/20 0.33
RORC P51449 1/20 0.33
RORB Q92753 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
BRD9 Q9H8M2 1/20 0.33

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
SCHEMBL10234059 0.79 BRD4 (0.43) BRD4KDM4ETP53L3MBTL1MAPK1
SCHEMBL8267803 0.79 BRD4 (0.55) BRD4L3MBTL1BRD9BRD7
SCHEMBL19000959 0.79 CA2 (0.35) ELANEKDM4ETP53L3MBTL1TDP1
SCHEMBL23957951 0.78 BRD4 (0.35) BRD4BRD9BRD7
SCHEMBL23957955 0.78 KDM5A (0.34) BRD4TDP1BRD9BRD7
SCHEMBL26597058 0.78 BRD4 (0.39) BRD4ELANEKDM4ETP53L3MBTL1
SCHEMBL23957952 0.77 NPC1 (0.37) BRD4KDM4EL3MBTL1
SCHEMBL23957954 0.77 NPC1 (0.37) BRD4L3MBTL1
SCHEMBL14584041 0.77 GPR3 (0.37) KDM4EL3MBTL1MAPK1TDP1TSHR
SCHEMBL25004046 0.75 L3MBTL1 (0.40) BRD4ELANEKDM4ETP53L3MBTL1

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-20210330646-A1 FASCIN BINDING COMPOUNDS FOR SPINOGENESIS SPINOGENIX, INC. 2021-10-28 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-20210330646-A1 FASCIN BINDING COMPOUNDS FOR SPINOGENESIS FSCN1, SMN1; SMN2, DCX BRD4 1546/4885ELANE 1869/4885KDM4E 3816/4885

“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.