SCHEMBL25809366

SCHEMBL25809366

Cc1nc(Cl)nc(NCCCN(C)CCCNc2nc(Cl)nc(Cl)n2)n1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
LMNA P02545 1/20 0.39
PIK3CA P42336 1/20 0.39
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
NR1I2 O75469 1/20 0.34
AHR P35869 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
SCHEMBL24622129 0.92 KMT2A (0.51) KMT2ALMNANR1I2AHR
SCHEMBL25809403 0.83 KMT2A (0.51) KMT2ALMNACA12CA1CA2
SCHEMBL10352703 0.83 KMT2A (0.57) KMT2ALMNAPIK3CACA12CA1
SCHEMBL5486033 0.81 KMT2A (0.51) KMT2ALMNA
SCHEMBL4376048 0.78 KMT2A (0.60) KMT2ALMNACA12CA1CA2
SCHEMBL20805828 0.77 KMT2A (0.69) KMT2ALMNANR1I2AHR
SCHEMBL13558679 0.74 KMT2A (0.53) KMT2ALMNACA12CA1CA2
SCHEMBL20053796 0.74 KMT2A (0.58) KMT2ALMNACA12CA1CA2
SCHEMBL140123 0.72 KMT2A (0.61) KMT2ALMNACA12CA1CA2
SCHEMBL169523 0.71 KCNH3 (0.45) KMT2ALMNAPIK3CANR1I2AHR

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-11702712-B2 Cationic cyanuric chloride derivative tanning agent and preparation method thereof SHAANXI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2023-07-18 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-11702712-B2 Cationic cyanuric chloride derivative tanning agent and preparation method thereof C9, PROC, TYR KMT2A 3823/4885LMNA 2491/4885PIK3CA 4490/4885

“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.