SCHEMBL3060967

SCHEMBL3060967

Clc1ccc(Nc2nc3nonc3nc2Nc2ccccc2Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.56
SMN1; SMN2 Q16637 7/20 0.56
TP53 P04637 6/20 0.56
POLB P06746 2/20 0.56
CDKN1A P38936 1/20 0.44
CCR2 P41597 1/20 0.44
CCR5 P51681 1/20 0.44
GAA P10253 2/20 0.43
RECQL P46063 1/20 0.43
AURKA O14965 2/20 0.42
TSHR P16473 2/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HTT P42858 2/20 0.40
USP2 O75604 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPY5R Q15761 1/20 0.40
IGF1R P08069 1/20 0.40
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39

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
SCHEMBL17249529 0.89 TSHR (0.49) MAPTSMN1; SMN2TP53POLBCCR2
SCHEMBL3050870 0.86 SMN1; SMN2 (0.65) MAPTSMN1; SMN2TP53POLBCDKN1A
SCHEMBL3055713 0.86 MAPT (0.50) MAPTSMN1; SMN2TP53POLBCDKN1A
Ammonia Solution, Strong SCHEMBL4268234 0.80 TP53 (0.52) MAPTSMN1; SMN2TP53POLBCCR2
SCHEMBL21499859 0.79 NPC1 (0.43) MAPTSMN1; SMN2TP53POLBAURKA
SCHEMBL17249531 0.79 GAA (0.66) MAPTSMN1; SMN2TP53POLBCDKN1A
SCHEMBL3063373 0.77 MAPT (0.46) MAPTSMN1; SMN2TP53POLBCCR2
SCHEMBL3051333 0.76 MAPT (0.54) MAPTSMN1; SMN2TP53POLBCDKN1A
SCHEMBL21499795 0.76 MAPT (0.54) MAPTSMN1; SMN2TP53POLBCCR2
SCHEMBL11175497 0.76 GAA (0.49) MAPTSMN1; SMN2TP53POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178754-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2012-07-12 US claimed
US-20100222356-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2010-09-02 US claimed
EP-1799689-A1 FURAZANO `3, 4-B ! PYRAZYNES AND THEIR USE AS ANTI-TUMOR AGENTS Compass Pharmaceuticals LLC (US) 2007-06-27 EP claimed
WO-2006044402-A1 FURAZANO `3, 4-B ! PYRAZYNES AND THEIR USE AS ANTI-TUMOR AGENTS COMPASS PHARMACEUTICALS LLC (US) 2006-04-27 WO claimed
US-20120178754-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2012-07-12 US disclosed
US-20100222356-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2010-09-02 US disclosed
EP-1799689-A1 FURAZANO `3, 4-B ! PYRAZYNES AND THEIR USE AS ANTI-TUMOR AGENTS Compass Pharmaceuticals LLC (US) 2007-06-27 EP disclosed
WO-2006044402-A1 FURAZANO `3, 4-B ! PYRAZYNES AND THEIR USE AS ANTI-TUMOR AGENTS COMPASS PHARMACEUTICALS LLC (US) 2006-04-27 WO 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-20100222356-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents CDC73, VHL, RB1 MAPT 3908/4885SMN1; SMN2 243/4885TP53 4/4885
US-20120178754-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents CDC73, VHL, RB1 MAPT 3908/4885SMN1; SMN2 243/4885TP53 4/4885

“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.