SCHEMBL26051103

SCHEMBL26051103

Cc1cnc(-c2nc3cc(C)ccc3[nH]2)c(CO)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CBFB Q13951 4/20 0.41
▸ ATR Q13535 2/20 0.40
▸ RUNX1 Q01196 2/20 0.38
▸ MAP2K4 P45985 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ MAPKAPK2 P49137 1/20 0.38
▸ MAPKAPK3 Q16644 1/20 0.38
▸ MAPK6 Q16659 1/20 0.38
▸ METAP2 P50579 2/20 0.36
▸ METAP1 P53582 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL19228816 0.87 CBFB (0.45) CBFBATRRUNX1MAP2K4MAPK1
SCHEMBL19228812 0.83 RUNX1 (0.56) CBFBATRRUNX1MAP2K4MAPK1
SCHEMBL19228808 0.78 RUNX1 (0.57) ATRRUNX1
SCHEMBL19228814 0.77 ACHE (0.56) RUNX1
SCHEMBL19228806 0.77 RUNX1 (0.55) RUNX1
SCHEMBL19228805 0.76 RUNX1 (0.68) RUNX1ALDH1A1
SCHEMBL26051105 0.75 CBFB (0.40) CBFBRUNX1MAP2K4MAPK1MAPKAPK2
SCHEMBL19228807 0.75 RUNX1 (0.52) RUNX1KMT2AMEN1KDM4EALDH1A1
SCHEMBL1171203 0.74 NPC1 (0.51) CBFBMETAP2METAP1KMT2AMAPT
SCHEMBL26158811 0.73 METAP2 (0.52) CBFBMETAP2METAP1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230277454-A1 NANO-EMULSION OF CBFß-RUNX1 INHIBITOR FOR OCULAR DRUG DELIVER MASSACHUSETTS EYE AND EAR INFIRMARY 2023-09-07 — — US disclosed
US-11739326-B2 RUNX1 inhibition for treatment of proliferative vitreoretinopathy and conditions associated with epithelial to mesenchymal transition MASSACHUSETTS EYE AND EAR INFIRMARY (US) 2023-08-29 — — 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 (2 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-11739326-B2 RUNX1 inhibition for treatment of proliferative vitreoretinopathy and conditions associated with epithelial to mesenchymal transition RUNX1, CXCL12, MITF CBFB 7/4885ATR 1114/4885RUNX1 1/4885
US-20230277454-A1 NANO-EMULSION OF CBFß-RUNX1 INHIBITOR FOR OCULAR DRUG DELIVER RUNX1, CBFB, IKZF1 CBFB 2/4885ATR 1857/4885RUNX1 1/4885

“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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