SCHEMBL4765196

SCHEMBL4765196

Cc1cc(=O)n(Cc2ccoc2)c(=O)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 4/20 0.38
ALDH1A1 P00352 6/20 0.38
MAPT P10636 3/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 2/20 0.37
CYP3A4 P08684 1/20 0.37
ATM Q13315 1/20 0.37
KDM4E B2RXH2 2/20 0.36
TLR7 Q9NYK1 1/20 0.36
PSMD14 O00487 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 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
SCHEMBL6243233 0.81 KMT2A (0.55) KMT2ASMN1; SMN2MEN1ALDH1A1MAPT
SCHEMBL4764015 0.77 KMT2A (0.69) KMT2ASMN1; SMN2MEN1ALDH1A1MAPT
SCHEMBL4864080 0.77 TYMS (0.48) KMT2ASMN1; SMN2MEN1ALDH1A1MAPT
SCHEMBL4762572 0.76 ALDH1A1 (0.63) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL4769449 0.76 KMT2A (0.44) KMT2ASMN1; SMN2MEN1ALDH1A1MAPT
SCHEMBL5801672 0.72 L3MBTL1 (0.59) KMT2AMEN1POLBATM
SCHEMBL4767367 0.70 HSPD1 (0.41) KMT2ASMN1; SMN2MEN1ALDH1A1MAPT
SCHEMBL4771370 0.70 ALDH1A1 (0.53) KMT2ASMN1; SMN2MEN1ALDH1A1MAPT
SCHEMBL9420347 0.70 KMT2A (0.52) KMT2AMEN1ALDH1A1POLBHPGD
SCHEMBL11378716 0.70 BRAF (0.44) KMT2AMEN1ALDH1A1MAPTATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1678181-B1 A2B ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS INC (US) 2008-12-31 EP disclosed
US-7449473-B2 Substituted pyrrolo[3,2-d]pyrimidin-2,4-diones as A2b adenosine receptor antagonists CV THERAPEUTICS, INC. (US) 2008-11-11 US disclosed
US-20050119287-A1 A2B adenosine receptor antagonists GILEAD PALO ALTO, INC. 2005-06-02 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-20050119287-A1 A2B adenosine receptor antagonists ADORA2B, ADORA2A, ADORA3 KMT2A 1806/4885SMN1; SMN2 3995/4885MEN1 4726/4885

“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.