SCHEMBL23575784

SCHEMBL23575784

O=C(NC1CC1)c1cnc2cc(F)c(Br)cc2c1NC12CC(C1)C2

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.39
HPGD P15428 2/20 0.37
JAK2 O60674 2/20 0.36
JAK1 P23458 2/20 0.36
JAK3 P52333 1/20 0.36
MAP4K4 O95819 2/20 0.36
MELK Q14680 4/20 0.35
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35
IRAK4 Q9NWZ3 4/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
KCNH2 Q12809 1/20 0.33
ATM Q13315 1/20 0.33
TYK2 P29597 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
SCHEMBL23575790 0.88 NUDT1 (0.41) EGFRJAK2JAK1JAK3MELK
SCHEMBL23575542 0.86 JAK2 (0.39) EGFRJAK2JAK1JAK3MELK
SCHEMBL23575840 0.84 HPGD (0.40) EGFRHPGDMAP4K4MELKIRAK4
SCHEMBL23575459 0.80 MEN1 (0.46) HPGDL3MBTL1
SCHEMBL23575535 0.80 NUDT1 (0.48) EGFR
SCHEMBL23575301 0.76 ALOX5AP (0.39) MAP4K4MELKKCNH2ATM
SCHEMBL15190704 0.72 MELK (0.55) MELK
SCHEMBL15190705 0.72 MELK (0.55) MELK
SCHEMBL23590141 0.71 NUDT1 (0.42) EGFRHPGDMAP4K4MELKIRAK4
SCHEMBL23575780 0.71 LRRK2 (0.42) EGFRMELK

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-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 EGFR 3316/4885HPGD 1472/4885JAK2 4713/4885

“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.