SCHEMBL4772468

SCHEMBL4772468

CCOC(=O)/C(=C\c1ccnc(Cl)c1)C(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.53
KMT2A Q03164 7/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 10/20 0.46
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 3/20 0.46
HSP90AA1 P07900 2/20 0.46
HPGD P15428 2/20 0.46
NR1H4 Q96RI1 1/20 0.46
LMNA P02545 6/20 0.42
NPSR1 Q6W5P4 4/20 0.42
GPR55 Q9Y2T6 2/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
GAA P10253 2/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
CNR2 P34972 2/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL4772474 1.00 MEN1 (0.53) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL4777951 0.81 MEN1 (0.46) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL4777954 0.81 MEN1 (0.46) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL4778536 0.81 KMT2A (0.81) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL10414069 0.81 KMT2A (0.76) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL11688124 0.81 KMT2A (0.81) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL10414068 0.81 KMT2A (0.76) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL4778528 0.81 KMT2A (0.81) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL28857962 0.78 MEN1 (0.58) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL14047083 0.77 KMT2A (0.69) MEN1KMT2APOLBMAPTALDH1A1

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
US-7459451-B2 e.g. 1-Ethyl-4-(5-methyl-3-pyridyl)-6-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid; phosphodiesterase (PDE)-IV inhibitor or tumor necrosis factor (TNF)- alpha antagonist; autoimmune diseases, antidepressant, anxiolytic agent; polychondritis, scleroderma, fibrosis, arthritis, Alzheimer's disease ASTELLAS PHARMA INC. (JP) 2008-12-02 US disclosed
EP-1763528-B1 PYRAZOLOPYRIDINE DERIVATIVES ASTELLAS PHARMA INC (JP) 2008-11-26 EP disclosed
EP-1763528-A1 PYRAZOLOPYRIDINE DERIVATIVES Astellas Pharma Inc. (JP) 2007-03-21 EP disclosed
WO-2006004188-A1 PYRAZOLOPYRIDINE DERIVATIVES ASTELLAS PHARMA INC. (JP) 2006-01-12 WO disclosed
US-20060004003-A1 Pyrazolopyridine derivatives ASTELLAS PHARMA INC. (JP) 2006-01-05 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-20060004003-A1 Pyrazolopyridine derivatives PDE4A, PDE3B, PDE5A MEN1 3100/4885KMT2A 3727/4885POLB 1288/4885

“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.