SCHEMBL3083798

SCHEMBL3083798

CC(=O)c1cnn2cc(C)ccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHB3 P54753 3/20 0.57
NPC1 O15118 6/20 0.43
RAB9A P51151 6/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 2/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 2/20 0.42
KDM4E B2RXH2 4/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
TP53 P04637 1/20 0.41
TDP1 Q9NUW8 1/20 0.38
PDE2A O00408 3/20 0.37
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL1290703 0.88 EPHB3 (0.56) EPHB3SMN1; SMN2ALDH1A1KDM4ELMNA
SCHEMBL17453567 0.82 NPC1 (0.43) EPHB3NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL1290693 0.81 ALDH1A1 (0.52) EPHB3NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL3070760 0.81 EPHB3 (0.58) EPHB3NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL17323234 0.78 LCK (0.46) EPHB3NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL17453430 0.77 EIF4A3 (0.43) EPHB3NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL13139955 0.76 EPHB3 (0.56) EPHB3NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL17454436 0.76 NPC1 (0.39) EPHB3NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL2288826 0.76 JAK1 (0.45) EPHB3NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL1286674 0.75 NPC1 (0.68) EPHB3NPC1RAB9ASMN1; SMN2ALDH1A1

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 5 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

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 2757/4885NPC1 3271/4885RAB9A 1073/4885

“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.