SCHEMBL4159569

SCHEMBL4159569

Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2COP(O)(=S)O[C@H]2[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 1.00
MEN1 O00255 1/20 1.00
ALDH1A1 P00352 1/20 1.00
STING1 Q86WV6 15/20 0.80
LMNA P02545 2/20 0.78
RAPGEF3 O95398 2/20 0.78
GMNN O75496 1/20 0.78
BLM P54132 1/20 0.78
NPSR1 Q6W5P4 1/20 0.78
RAPGEF4 Q8WZA2 1/20 0.78
RXFP1 Q9HBX9 1/20 0.74

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
SCHEMBL15906306 1.00 KMT2A (1.00) KMT2AMEN1ALDH1A1STING1LMNA
SCHEMBL1106650 1.00 KMT2A (1.00) KMT2AMEN1ALDH1A1STING1LMNA
SCHEMBL1106664 1.00 KMT2A (1.00) KMT2AMEN1ALDH1A1STING1LMNA
SCHEMBL29515507 1.00 KMT2A (1.00) KMT2AMEN1ALDH1A1STING1LMNA
SCHEMBL10098850 1.00 KMT2A (1.00) KMT2AMEN1ALDH1A1STING1LMNA
SCHEMBL29368433 0.96 KMT2A (0.93) KMT2AMEN1ALDH1A1STING1LMNA
SCHEMBL29478470 0.96 KMT2A (0.93) KMT2AMEN1ALDH1A1STING1LMNA
Ammonia Solution, Strong SCHEMBL29465897 0.95 KMT2A (0.91) KMT2AMEN1ALDH1A1STING1LMNA
SCHEMBL29712629 0.94 KMT2A (0.88) KMT2AMEN1ALDH1A1STING1LMNA
SCHEMBL5151491 0.89 KMT2A (0.80) KMT2AMEN1ALDH1A1STING1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11185100-B2 Methods for modulating taste receptors MARS, INCORPORATED (US) 2021-11-30 US claimed
US-20090197279-A1 MICROTUBULE SYNTHESIS AS A BIOMARKER KINEMED, INC. (US) 2009-08-06 US disclosed
EP-1949085-A2 MICROTUBULE SYNTHESIS AS A BIOMARKER Kinemed, Inc. (US) 2008-07-30 EP disclosed
US-20070265223-A1 COMPOSITIONS AND METHODS OF ENHANCING SURVIVABILITY AND REDUCING INJURY OF CELLS, TISSUES, ORGANS, AND ORGANISMS UNDER HYPOXIC OR ISCHEMIC CONDITIONS IKARIA, INC. (US) 2007-11-15 US disclosed
WO-2007041611-A2 MICROTUBULE SYNTHESIS AS A BIOMARKER KINEMED, INC. (US) 2007-04-12 WO disclosed
US-5625056-A INHIBITORS OR STIMULANTS FOR KINASES FOR LIGANDS FOR CHROMATOGRAPHY BIOLOG LIFE SCIENCE INSTITUTE (DE) 1997-04-29 US disclosed
US-5552267-A PHOSPHODIESTERASE INHIBITORS, GLUCOSE, MAGNESIUM IONS, BUFFERS, MAGNESIUM IONS AS MACROMOLECULES THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1996-09-03 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-20070265223-A1 COMPOSITIONS AND METHODS OF ENHANCING SURVIVABILITY AND REDUCING INJURY OF CELLS, TISSUES, ORGANS, AND ORGANISMS UNDER HYPOXIC OR ISCHEMIC CONDITIONS ADORA2A, ADORA2B, ADORA1 KMT2A 3573/4885MEN1 4450/4885ALDH1A1 400/4885

“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.