SCHEMBL21180776

SCHEMBL21180776

CNC(=O)c1cc(C)cn1C

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 1/20 0.42
BRD4 O60885 1/20 0.38
MKNK2 Q9HBH9 1/20 0.37
BACE1 P56817 1/20 0.36
AR P10275 1/20 0.36
NR4A2 P43354 1/20 0.36
TP53 P04637 1/20 0.35
PKM P14618 2/20 0.35
HSD17B10 Q99714 1/20 0.35
THRB P10828 1/20 0.35
MMP13 P45452 1/20 0.34
PLK1 P53350 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
CLK1 P49759 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL26333281 0.82 MEN1 (0.42) BAZ2BBRD4ARNR4A2TP53
SCHEMBL21180762 0.79 MAPT (0.50) ARTP53SMN1; SMN2ALDH1A1
SCHEMBL22429678 0.79 BAZ2B (0.39) BAZ2BBRD4NR4A2TP53PKM
SCHEMBL14002829 0.78 BAZ2B (0.37) BAZ2BBRD4ARNR4A2TP53
SCHEMBL6900641 0.78 TOP1 (0.40) BAZ2BBRD4ARNR4A2TP53
SCHEMBL18665455 0.77 THRB (0.40) BAZ2BBRD4NR4A2TP53PKM
SCHEMBL13287985 0.77 AR (0.35) BAZ2BBRD4BACE1ARSMN1; SMN2
SCHEMBL3674837 0.77 TDP1 (0.46) BRD4ARHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL26831831 0.77 LMNA (0.43) BRD4TP53PKMMMP13ALDH1A1
SCHEMBL11199134 0.76 CYP1A2 (0.47) TP53PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024057020-A1 ANTI-VIRAL COMPOUNDS Infex Therapeutics Limited (GB) 2024-03-21 WO disclosed
WO-2023223055-A1 ANTI-VIRAL COMPOUNDS Infex Therapeutics Limited (GB) 2023-11-23 WO disclosed
WO-2021159993-A1 INHIBITORS OF INTERLEUKIN-1 RECEPTOR ASSOCIATED KINASE (IRAK) /FMS-LIKE RECEPTOR TYROSINE KINASE (FLT3), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF PHARMABLOCK SCIENCES (NANJING) , INC. (CN) 2021-08-19 WO disclosed
US-10358439-B2 DNA binding agents with a minor groove binding tail BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-07-23 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-10358439-B2 DNA binding agents with a minor groove binding tail TOP2B, TOP2A, TOP1 BAZ2B 1330/4885BRD4 846/4885MKNK2 3879/4885

“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.