SCHEMBL23575801

SCHEMBL23575801

CCOC(=O)c1cnc2cc(C(F)(F)F)c(Br)cc2c1NC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.50
RXFP1 Q9HBX9 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
MAPK1 P28482 2/20 0.49
MAPT P10636 5/20 0.48
TP53 P04637 2/20 0.48
AURKB Q96GD4 2/20 0.44
THRB P10828 1/20 0.44
PDE5A O76074 2/20 0.44
PDE6D O43924 1/20 0.44
PDE6A P16499 1/20 0.44
PDE6G P18545 1/20 0.44
PDE6B P35913 1/20 0.44
PDE6C P51160 1/20 0.44
PDE6H Q13956 1/20 0.44
AURKA O14965 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PKM P14618 1/20 0.43
CA2 P00918 1/20 0.42

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
SCHEMBL23575736 0.87 PDE4B (0.49) GAARXFP1NPSR1MAPK1MAPT
SCHEMBL23575691 0.86 MAPT (0.57) GAARXFP1MAPTTP53AURKB
SCHEMBL18530485 0.85 KDM4E (0.44) GAARXFP1NPSR1MAPK1MAPT
SCHEMBL23575679 0.85 MAPK1 (0.52) GAARXFP1NPSR1MAPK1MAPT
SCHEMBL18530521 0.84 KMT2A (0.45) GAARXFP1NPSR1MAPK1MAPT
SCHEMBL23575227 0.84 EGFR (0.41) TP53PKM
SCHEMBL23575251 0.83 PDE4B (0.44) GAARXFP1NPSR1MAPK1MAPT
SCHEMBL23575685 0.82 MAPT (0.55) GAARXFP1NPSR1MAPK1MAPT
SCHEMBL23575695 0.79 JAK3 (0.42) GAARXFP1NPSR1MAPK1MAPT
SCHEMBL23234973 0.78 MAPK1 (0.76) GAARXFP1NPSR1MAPK1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3846800-A1 COMPOUNDS FOR THE DEGRADATION OF BRD9 OR MTH1 C4 Therapeutics, Inc. (US) 2021-07-14 EP disclosed
US-20210198256-A1 COMPOUNDS FOR THE DEGRADATION OF BRD9 OR MTH1 C4 THERAPEUTICS, INC. (US) 2021-07-01 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-20210198256-A1 COMPOUNDS FOR THE DEGRADATION OF BRD9 OR MTH1 RBBP9, MTHFD1, BRWD1 GAA 1619/4885RXFP1 4025/4885NPSR1 4759/4885

“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.