SCHEMBL25635486

SCHEMBL25635486

CNC(=O)c1cc(N)ccc1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.57
MEN1 O00255 3/20 0.57
TDP1 Q9NUW8 3/20 0.57
MAPT P10636 2/20 0.57
THRB P10828 2/20 0.57
RECQL P46063 2/20 0.57
USP2 O75604 1/20 0.57
POLB P06746 1/20 0.57
PKM P14618 1/20 0.57
APEX1 P27695 1/20 0.57
BLM P54132 1/20 0.57
MCL1 Q07820 1/20 0.57
BRAF P15056 9/20 0.54
HDAC1 Q13547 9/20 0.54
HDAC3 O15379 6/20 0.54
HDAC4 P56524 6/20 0.54
HDAC7 Q8WUI4 6/20 0.54
HDAC2 Q92769 6/20 0.54
HDAC10 Q969S8 6/20 0.54
HDAC11 Q96DB2 6/20 0.54

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
SCHEMBL30871249 0.82 HDAC1 (0.52) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL1558074 0.82 MAPT (0.56) TDP1MAPTTHRBBRAFHDAC1
SCHEMBL2299271 0.82 ALOX5 (0.67) KMT2AMEN1TDP1MAPTTHRB
SCHEMBL31079645 0.82 CASP1 (0.45) KMT2AMEN1TDP1MAPTTHRB
SCHEMBL10156668 0.82 CASP1 (0.45) KMT2AMEN1TDP1MAPTTHRB
SCHEMBL6890987 0.82 BRAF (0.51) KMT2AMEN1MAPTTHRBBRAF
SCHEMBL14215697 0.82 MAPT (0.59) KMT2AMEN1TDP1MAPTTHRB
SCHEMBL2700198 0.82 MAPT (0.59) KMT2AMEN1TDP1MAPTTHRB
SCHEMBL690577 0.81 KEAP1 (0.61) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL2301531 0.81 GAA (0.56) KMT2AMEN1TDP1MAPTTHRB

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-20230173082-A1 ANTIBACTERIAL PRODUCTS UNIVERSITY OF LINCOLN (GB) 2023-06-08 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-20230173082-A1 ANTIBACTERIAL PRODUCTS XIAP, CLSPN, SLC47A2 KMT2A 4141/4885MEN1 3804/4885TDP1 4302/4885

“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.