SCHEMBL22863452

SCHEMBL22863452

Cc1cnc(C(C)(C)c2nccn2C)n1C

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.39
TSHR P16473 1/20 0.35
LPO P22079 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
SCHEMBL22863264 0.83 KMT2A (0.50) KMT2ATSHRLPO
SCHEMBL419709 0.71 KMT2A (0.50) KMT2ATSHRLPO
SCHEMBL14037751 0.70 PDE1A (0.33)
Hydrochloric Acid SCHEMBL16540240 0.69 KMT2A (0.48) KMT2ATSHRLPO
SCHEMBL8415398 0.67 KMT2A (0.56) KMT2ATSHRLPO
SCHEMBL21441893 0.67 LRRK2 (0.38)
SCHEMBL11050545 0.67 KMT2A (0.56) KMT2ATSHRLPO
SCHEMBL17544816 0.67 KMT2A (0.43) KMT2ATSHRLPO
SCHEMBL12440668 0.65 KMT2A (0.48) KMT2ATSHRLPO
SCHEMBL6251779 0.65 KMT2A (0.48) KMT2ATSHRLPO

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11332466-B2 Pyridinone-based epigenetic modifiers and uses thereof THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2022-05-17 US disclosed
US-20210002272-A1 PYRIDINONE-BASED EPIGENETIC MODIFIERS AND USES THEREOF UNIV ILLINOIS (US) 2021-01-07 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 (2 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-20210002272-A1 PYRIDINONE-BASED EPIGENETIC MODIFIERS AND USES THEREOF BRD1, BRD2, BRD3 KMT2A 286/4885TSHR 3351/4885LPO 4630/4885
US-11332466-B2 Pyridinone-based epigenetic modifiers and uses thereof BRD1, BRD2, BRD3 KMT2A 286/4885TSHR 3351/4885LPO 4630/4885

“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.