SCHEMBL26047508

SCHEMBL26047508

CCn1ccc(NC(=O)c2cc3c(nc2OC)nc(C(c2ccccc2)c2ccccc2)n3CC)n1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACSS2 Q9NR19 7/20 0.47
▸ MAP3K5 Q99683 2/20 0.37
▸ MAPK1 P28482 4/20 0.36
▸ RAF1 P04049 1/20 0.36
▸ RIPK1 Q13546 1/20 0.36
▸ CACNA1G O43497 2/20 0.35
▸ CACNA1H O95180 2/20 0.35
▸ CACNA1I Q9P0X4 2/20 0.35
▸ ELOVL1 Q9BW60 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ LDHB P07195 1/20 0.34

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
SCHEMBL25432373 0.92 ACSS2 (0.46) ACSS2MAP3K5MAPK1RAF1RIPK1
SCHEMBL26046859 0.85 ACSS2 (0.64) ACSS2MAP3K5MAPK1RIPK1ALDH1A1
SCHEMBL26047373 0.85 ACSS2 (0.46) ACSS2MAP3K5MAPK1RIPK1CACNA1H
SCHEMBL26046870 0.84 ACSS2 (0.46) ACSS2RIPK1
SCHEMBL26047502 0.84 ACSS2 (0.46) ACSS2MAP3K5MAPK1RIPK1
SCHEMBL25368529 0.82 ACSS2 (0.67) ACSS2
SCHEMBL26047485 0.81 ACSS2 (0.57) ACSS2MAPK1RIPK1ALDH1A1
SCHEMBL26047445 0.81 ACSS2 (0.57) ACSS2MAP3K5MAPK1RIPK1ALDH1A1
SCHEMBL26047459 0.81 ACSS2 (0.45) ACSS2RIPK1ALDH1A1RAB9A
SCHEMBL26047368 0.80 ACSS2 (0.60) ACSS2RIPK1LMNA

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 201/4885MAP3K5 688/4885MAPK1 1741/4885

“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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