SCHEMBL3083560

SCHEMBL3083560

CC(=O)c1cnn2cccc(C)c12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHB3 P54753 2/20 0.58
MAPK1 P28482 1/20 0.47
NPC1 O15118 6/20 0.44
RAB9A P51151 6/20 0.44
ALDH1A1 P00352 4/20 0.44
HPGD P15428 3/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 1/20 0.44
KDM4E B2RXH2 3/20 0.42
TP53 P04637 1/20 0.42
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
DRD2 P14416 2/20 0.38
DRD4 P21917 2/20 0.38
DRD3 P35462 2/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
KLF5 Q13887 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL1290436 0.87 EPHB3 (0.58) EPHB3MAPK1NPC1RAB9AALDH1A1
SCHEMBL22259354 0.82 EPHB3 (0.45) EPHB3MAPK1NPC1RAB9AALDH1A1
SCHEMBL7373294 0.80 MAPK1 (0.44) EPHB3MAPK1NPC1RAB9AALDH1A1
SCHEMBL18412881 0.77 DRD2 (0.42) EPHB3MAPK1NPC1RAB9AALDH1A1
SCHEMBL21236685 0.76 EPHB3 (0.46) EPHB3NPC1RAB9ALMNAHTT
SCHEMBL24612190 0.74 ALDH1A1 (0.40) EPHB3MAPK1NPC1RAB9AALDH1A1
SCHEMBL1286674 0.72 NPC1 (0.68) EPHB3NPC1RAB9AALDH1A1HPGD
SCHEMBL21893810 0.72 EPHB3 (0.43) EPHB3NPC1RAB9AALDH1A1KDM4E
SCHEMBL3079162 0.71 EPHB3 (0.43) EPHB3NPC1RAB9AALDH1A1MAPT
SCHEMBL7308374 0.71 HTR3E (0.51) MAPTSMN1; SMN2LMNAHTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2176260-A1 PYRAZOLO[1,5-A]PYRIDINES AND THEIR USE IN CANCER THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2010-04-21 EP claimed
WO-2009008748-A1 PYRAZOLO[1,5-A]PYRIDINES AND THEIR USE IN CANCER THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2009-01-15 WO claimed
US-20100226881-A1 PYRAZOLO[1,5-a]PYRIDINES AND THEIR USE IN CANCER THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2010-09-09 US disclosed
EP-2176260-A1 PYRAZOLO[1,5-A]PYRIDINES AND THEIR USE IN CANCER THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2010-04-21 EP disclosed
WO-2009008748-A1 PYRAZOLO[1,5-A]PYRIDINES AND THEIR USE IN CANCER THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2009-01-15 WO disclosed
EP-0368343-A2 Ameliorating composition for dysmnesia KYORIN SEIYAKU KABUSHIKI KAISHA (JP) 1990-05-16 EP 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-20100226881-A1 PYRAZOLO[1,5-a]PYRIDINES AND THEIR USE IN CANCER THERAPY TP53, PNPO, DPYD EPHB3 2757/4885MAPK1 602/4885NPC1 3271/4885

“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.