SCHEMBL6612468

SCHEMBL6612468

CCOC(=O)c1cncnc1Oc1ccc2c(c1)OCO2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
LMNA P02545 3/20 0.50
JAK2 O60674 1/20 0.48
JAK3 P52333 1/20 0.48
ALDH1A1 P00352 6/20 0.47
HSD17B10 Q99714 4/20 0.47
MAPT P10636 4/20 0.47
KDM4E B2RXH2 3/20 0.47
HPGD P15428 3/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
OGA O60502 3/20 0.46
ALOX15 P16050 4/20 0.44
HTT P42858 3/20 0.44
NPSR1 Q6W5P4 3/20 0.44
TP53 P04637 2/20 0.43
RAB9A P51151 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NPC1 O15118 2/20 0.43

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
SCHEMBL6611896 0.84 LMNA (0.45) TSHRSMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL7375134 0.83 TSHR (0.71) TSHRSMN1; SMN2LMNAJAK2JAK3
SCHEMBL6485391 0.79 HSD17B10 (0.48) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL15897072 0.78 CYP1A2 (0.49) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL6613395 0.78 CYP1A2 (0.49) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL7684125 0.77 LMNA (0.62) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL6804123 0.75 HPGD (0.46) TSHRSMN1; SMN2ALDH1A1HSD17B10MAPT
SCHEMBL6613616 0.75 POLB (0.48) TSHRSMN1; SMN2LMNAALDH1A1HSD17B10
SCHEMBL6615379 0.74 MAPK8 (0.52) SMN1; SMN2LMNAALDH1A1MAPTKDM4E
SCHEMBL6613947 0.74 ALDH1A1 (0.45) TSHRSMN1; SMN2LMNAALDH1A1HPGD

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-1252157-B1 PYRIMIDINE CARBOXAMIDES USEFUL AS INHIBITORS OF PDE4 ISOZYMES PFIZER PROD INC (US) 2004-06-23 EP disclosed
US-6740655-B2 3',5'-CYCLIC NUCLEOTIDE PHOSPHODIESTERASE 4-SPECIFIC INHIBITORS REDUCE EOSINOPHIL INFLUX TO THE LUNGS; SIDE EFFECT REDUCTION; ANTIINFLAMMATORY AGENT; ANTIALLERGENS; RESPIRATORY SYSTEM DISORDERS, ESPECIALLY ASTHMA PFIZER INC 2004-05-25 US disclosed
US-20030144300-A1 Pyrimidine carboxamides useful as inhibitors of pde4 isozymes PFIZER PRODUCTS INC. 2003-07-31 US disclosed
EP-1252157-A1 PYRIMIDINE CARBOXAMIDES USEFUL AS INHIBITORS OF PDE4 ISOZYMES Pfizer Products Inc. (US) 2002-10-30 EP disclosed
WO-2001057025-A1 PYRIMIDINE CARBOXAMIDES USEFUL AS INHIBITORS OF PDE4 ISOZYMES PFIZER PRODUCTS INC. (US) 2001-08-09 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-20030144300-A1 Pyrimidine carboxamides useful as inhibitors of pde4 isozymes PDE12, PDE4A, PDE4B TSHR 3727/4885SMN1; SMN2 4365/4885LMNA 4597/4885

“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.