SCHEMBL26047387

SCHEMBL26047387

CCc1cnc(NC(=O)c2cc3c(nc2OC)nc(C(c2ccccc2)c2ccccc2)n3CC)o1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACSS2 Q9NR19 8/20 0.71
▸ PDE4A P27815 1/20 0.36
▸ PDE4B Q07343 1/20 0.36
▸ PDE4C Q08493 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ MAPK1 P28482 3/20 0.33
▸ RIPK1 Q13546 5/20 0.32
▸ PABPC1 P11940 1/20 0.32
▸ MAP3K5 Q99683 1/20 0.32
▸ MAPT P10636 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL26047413 0.88 ACSS2 (0.54) ACSS2RIPK1MAPTMEN1KMT2A
SCHEMBL26047384 0.84 ACSS2 (0.70) ACSS2MAPK1PABPC1MAPTMEN1
SCHEMBL25366663 0.83 ACSS2 (1.00) ACSS2
SCHEMBL26047404 0.81 ACSS2 (0.47) ACSS2MAPK1POLBKMT2A
SCHEMBL26046870 0.81 ACSS2 (0.46) ACSS2RIPK1
SCHEMBL26047373 0.80 ACSS2 (0.46) ACSS2MAPK1RIPK1PABPC1MAP3K5
SCHEMBL26047502 0.80 ACSS2 (0.46) ACSS2MAPK1RIPK1MAP3K5
SCHEMBL26046859 0.80 ACSS2 (0.64) ACSS2MAPK1RIPK1PABPC1MAP3K5
SCHEMBL26047508 0.79 ACSS2 (0.47) ACSS2MAPK1RIPK1MAP3K5
SCHEMBL26047459 0.79 ACSS2 (0.45) ACSS2RIPK1MAPT

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-20230271956-A1 AMIDE DERIVATIVES MERCK PATENT GMBH (DE) 2023-08-31 — — 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-20230271956-A1 AMIDE DERIVATIVES BRCA1, HRAS, PCNA ACSS2 201/4885PDE4A 2417/4885PDE4B 2847/4885

“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.

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