SCHEMBL25802646

SCHEMBL25802646

C=C(OC)C(Cc1c[nH]c2ccccc12)NC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ HCRTR1 O43613 1/20 0.52
▸ HTR2A P28223 2/20 0.51
▸ ADRB1 P08588 1/20 0.51
▸ HTR1A P08908 1/20 0.51
▸ ADRA2A P08913 1/20 0.51
▸ SLC6A2 P23975 1/20 0.51
▸ HTR1D P28221 1/20 0.51
▸ HTR1B P28222 1/20 0.51
▸ HTR2C P28335 1/20 0.51
▸ HTR1E P28566 1/20 0.51
▸ SLC6A4 P31645 1/20 0.51
▸ HTR7 P34969 1/20 0.51
▸ HTR2B P41595 1/20 0.51
▸ HTR6 P50406 1/20 0.51
▸ SLC6A3 Q01959 1/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ ACE P12821 2/20 0.50
▸ MAPT P10636 2/20 0.50

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
SCHEMBL27043147 0.86 ALOX15 (0.56) KMT2AMEN1HTR2AADRB1HTR1A
SCHEMBL8531507 0.84 KMT2A (0.67) KMT2AMEN1HCRTR1ALOX15MAPT
SCHEMBL5613868 0.84 KMT2A (0.67) KMT2AMEN1HCRTR1ALOX15MAPT
SCHEMBL5613870 0.84 KMT2A (0.67) KMT2AMEN1HCRTR1ALOX15MAPT
Hydrochloric Acid SCHEMBL8531505 0.83 KMT2A (0.66) KMT2AMEN1HCRTR1ALOX15MAPT
Hydrochloric Acid SCHEMBL8531502 0.83 KMT2A (0.66) KMT2AMEN1HCRTR1ALOX15MAPT
Hydrochloric Acid SCHEMBL10641592 0.83 KMT2A (0.66) KMT2AMEN1HCRTR1ALOX15MAPT
SCHEMBL26372592 0.82 KDM4E (0.62) KMT2AMEN1HCRTR1HTR2AADRB1
Abrine SCHEMBL161767 0.81 ALOX15 (0.70) KMT2AMEN1ALOX15ACEMAPT
Abrine (L) SCHEMBL18777 0.81 ALOX15 (0.70) KMT2AMEN1ALOX15ACEMAPT

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-11692003-B2 Mithramycin derivatives having increased selectivity and anti-cancer activity UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2023-07-04 — — 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-11692003-B2 Mithramycin derivatives having increased selectivity and anti-cancer activity MELK, TFAM, MDK KMT2A 183/4885MEN1 797/4885HCRTR1 4791/4885

“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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