SCHEMBL23957951

SCHEMBL23957951

CC(C)(C)c1cn(C(C)(C)C)c(=O)c2ccncc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 10/20 0.35
BRD9 Q9H8M2 2/20 0.34
BRD7 Q9NPI1 2/20 0.34
KDM5A P29375 1/20 0.34
NFATC1 O95644 2/20 0.33
GSK3B P49841 2/20 0.33
DYRK1A Q13627 2/20 0.33
TAF1 P21675 1/20 0.33
TGFBR1 P36897 1/20 0.33
BRPF1 P55201 1/20 0.33
ACVR1 Q04771 1/20 0.33
BPTF Q12830 1/20 0.33
TAF1L Q8IZX4 1/20 0.33
CREBBP Q92793 1/20 0.33
CECR2 Q9BXF3 1/20 0.33
BAZ2B Q9UIF8 1/20 0.33
ATAD2B Q9ULI0 1/20 0.33
KAT2B Q92831 1/20 0.33
FEN1 P39748 1/20 0.33
ADORA3 P0DMS8 1/20 0.32

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
SCHEMBL23957955 0.94 KDM5A (0.34) BRD4BRD9BRD7KDM5ANFATC1
SCHEMBL19869985 0.83 BRD4 (0.46) BRD4BRD9BRD7NFATC1GSK3B
SCHEMBL23957953 0.78 BRD4 (0.37) BRD4BRD9BRD7
SCHEMBL19869619 0.76 BRD4 (0.44) BRD4BRD9BRD7NFATC1GSK3B
SCHEMBL18350677 0.72 KIF11 (0.35) NFATC1GSK3BDYRK1AKAT2BIDO1
SCHEMBL30171226 0.71 HTR2A (0.38) KDM5ADYRK1AFEN1IDO1
SCHEMBL28948256 0.71 HTR2A (0.38) KDM5ADYRK1AFEN1IDO1
SCHEMBL23957954 0.71 NPC1 (0.37) BRD4KAT2BFEN1
SCHEMBL23957952 0.71 NPC1 (0.37) BRD4KAT2BFEN1
SCHEMBL21363431 0.70 KDM4C (0.42) KDM5AIDO1

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 1546/4885BRD9 4425/4885BRD7 3911/4885

“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.