SCHEMBL26047003

SCHEMBL26047003

CCc1c(C(OI)(c2ccccc2C)c2ccccc2F)nn2cc(OC)c(C(=O)Nc3ncn(CC)n3)cc12

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACSS2 Q9NR19 4/20 0.54
▸ GLA P06280 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ KMT2A Q03164 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ DHODH Q02127 5/20 0.32
▸ RIPK1 Q13546 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ MAPT P10636 1/20 0.30

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
SCHEMBL26046982 0.94 ACSS2 (0.56) ACSS2GLAALOX15KMT2ADHODH
SCHEMBL26046975 0.92 ACSS2 (0.65) ACSS2GLAALOX15RIPK1
SCHEMBL23832307 0.88 ACSS2 (0.64) ACSS2GLAALOX15KMT2APOLB
SCHEMBL26047022 0.86 ACSS2 (0.47) ACSS2GLAALOX15
SCHEMBL30640950 0.82 ACSS2 (0.65) ACSS2GLAALOX15KMT2AMAPT
SCHEMBL23843514 0.82 ACSS2 (0.65) ACSS2GLAALOX15KMT2AMAPT
SCHEMBL26044506 0.80 ACSS2 (0.80) ACSS2GLAALOX15RIPK1SMN1; SMN2
SCHEMBL25434252 0.79 ACSS2 (0.68) ACSS2GLAALOX15KMT2ASMN1; SMN2
SCHEMBL23843491 0.78 ACSS2 (0.79) ACSS2GLAALOX15MAPT
SCHEMBL30640961 0.78 ACSS2 (0.79) ACSS2GLAALOX15MAPT

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 201/4885GLA 1335/4885ALOX15 2890/4885

“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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