SCHEMBL24353248

SCHEMBL24353248

COc1cccc(CN(C)Cc2nc(N(C)C)c3c(C)c(C)sc3n2)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.43
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 4/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ POLB P06746 3/20 0.40
▸ ACHE P22303 2/20 0.40
▸ BCHE P06276 1/20 0.40
▸ HSD17B2 P37059 2/20 0.39
▸ ROCK1 Q13464 1/20 0.39
▸ HPGD P15428 2/20 0.39
▸ RECQL P46063 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ GBA1 P04062 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL24353180 0.93 LMNA (0.43) PKMKMT2AMEN1LMNASMN1; SMN2
SCHEMBL18456786 0.89 PKM (0.45) PKMKMT2AMEN1LMNASMN1; SMN2
SCHEMBL24353221 0.84 PDE4A (0.45) PKMKMT2AMEN1LMNAALDH1A1
SCHEMBL24353217 0.83 PKM (0.40) PKMKMT2AMEN1LMNASMN1; SMN2
SCHEMBL24353322 0.82 ALDH1A1 (0.46) PKMKMT2AMEN1LMNAALDH1A1
SCHEMBL24353218 0.82 ALDH1A1 (0.46) PKMKMT2AMEN1LMNASMN1; SMN2
SCHEMBL24353182 0.81 ALDH1A1 (0.44) PKMKMT2AMEN1LMNASMN1; SMN2
SCHEMBL24353229 0.81 ALDH1A1 (0.43) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL24353318 0.81 ALDH1A1 (0.48) LMNAALDH1A1HTTKDM4E
SCHEMBL18456744 0.81 ALDH1A1 (0.43) KMT2AMEN1LMNASMN1; SMN2ALDH1A1

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-11312690-B2 Compounds, compositions, methods for treating diseases, and methods for preparing compounds UNIVERSITY OF LOUSVILLE RESEARCH FOUNDATION, INC. (US) 2022-04-26 — — 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-11312690-B2 Compounds, compositions, methods for treating diseases, and methods for preparing compounds VHL, C5, KRAS PKM 1542/4885KMT2A 1240/4885MEN1 35/4885

“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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