SCHEMBL24606231

SCHEMBL24606231

CCCCNc1ccc2c3c(cccc13)C(=O)N(CCC(=O)C(C)(C)C)C2=O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.74
▸ MAPT P10636 3/20 0.74
▸ HTT P42858 3/20 0.74
▸ MEN1 O00255 3/20 0.74
▸ USP2 O75604 2/20 0.74
▸ MAPK1 P28482 2/20 0.74
▸ L3MBTL1 Q9Y468 2/20 0.74
▸ NPSR1 Q6W5P4 2/20 0.74
▸ RGS12 O14924 1/20 0.74
▸ POLB P06746 1/20 0.74
▸ ATM Q13315 1/20 0.74
▸ TLR9 Q9NR96 1/20 0.74
▸ TDP1 Q9NUW8 1/20 0.74
▸ DYRK3 O43781 1/20 0.68
▸ RPS6KB1 P23443 1/20 0.68
▸ EPHA2 P29317 1/20 0.68
▸ FLT4 P35916 1/20 0.68
▸ CSNK2A1 P68400 1/20 0.68
▸ HDAC1 Q13547 6/20 0.64
▸ HDAC6 Q9UBN7 6/20 0.64

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
SCHEMBL372370 0.85 KMT2A (1.00) KMT2AMAPTHTTMEN1USP2
SCHEMBL29460431 0.85 KMT2A (1.00) KMT2AMAPTHTTMEN1USP2
SCHEMBL19718354 0.84 KMT2A (0.86) KMT2AMAPTHTTMEN1USP2
SCHEMBL7523337 0.82 KMT2A (0.84) KMT2AMAPTHTTMEN1USP2
SCHEMBL1505179 0.82 KMT2A (0.88) KMT2AMAPTHTTMEN1USP2
SCHEMBL7524308 0.82 KMT2A (0.69) KMT2AMAPTHTTMEN1USP2
SCHEMBL7153098 0.82 DYRK3 (0.71) KMT2AMAPTHTTMEN1USP2
SCHEMBL14817833 0.81 KMT2A (0.82) KMT2AMAPTHTTMEN1USP2
SCHEMBL7521157 0.81 DYRK3 (0.71) KMT2AMAPTHTTMEN1USP2
SCHEMBL8397978 0.81 KMT2A (0.86) KMT2AMAPTHTTMEN1USP2

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-20220213232-A1 BIOHYBRID PEPTIDOGLYCAN OLIGOMERS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2022-07-07 — — 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-20220213232-A1 BIOHYBRID PEPTIDOGLYCAN OLIGOMERS NOD2, DDOST, CD14 KMT2A 4840/4885MAPT 1730/4885HTT 2326/4885

“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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