SCHEMBL15436726

SCHEMBL15436726

CCOC(=O)c1cnn(CC2OC(C)=NC2(C)C)c1OCC

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
NPC1 O15118 3/20 0.41
ALDH1A1 P00352 6/20 0.39
HPGD P15428 5/20 0.39
RAB9A P51151 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 2/20 0.39
HIF1A Q16665 1/20 0.39
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.37
CSNK1D P48730 1/20 0.37
MAPT P10636 2/20 0.36
PDE4B Q07343 2/20 0.36
MEN1 O00255 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 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
SCHEMBL15436464 0.92 LMNA (0.40) LMNANPC1ALDH1A1HPGDRAB9A
SCHEMBL15436456 0.91 LMNA (0.39) LMNANPC1ALDH1A1HPGDRAB9A
SCHEMBL15436684 0.89 LMNA (0.40) LMNANPC1ALDH1A1HPGDRAB9A
SCHEMBL23273674 0.77 NPC1 (0.52) LMNANPC1ALDH1A1HPGDRAB9A
SCHEMBL1198982 0.74 NPC1 (0.49) LMNANPC1ALDH1A1HPGDRAB9A
SCHEMBL15436730 0.71 NPC1 (0.46) LMNANPC1ALDH1A1HPGDRAB9A
SCHEMBL1198694 0.71 NPC1 (0.49) LMNANPC1ALDH1A1HPGDRAB9A
SCHEMBL3265402 0.71 SMN1; SMN2 (0.60) LMNANPC1ALDH1A1HPGDRAB9A
SCHEMBL3261727 0.70 RAB9A (0.50) LMNANPC1ALDH1A1HPGDRAB9A
SCHEMBL3264275 0.65 ALDH1A1 (0.71) LMNANPC1ALDH1A1HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2687515-A1 METHOD FOR PRODUCING PYRAZOLECARBOXYLIC ACID DERIVATIVE Shionogi & Co., Ltd. (JP) 2014-01-22 EP disclosed
US-20140012013-A1 METHOD FOR PRODUCING PYRAZOLE CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 2014-01-09 US disclosed
US-20140012013-A1 METHOD FOR PRODUCING PYRAZOLE CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 2014-01-09 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-20140012013-A1 METHOD FOR PRODUCING PYRAZOLE CARBOXYLIC ACID DERIVATIVE HSD11B1, HSD11B2, HSD17B1 LMNA 4329/4885NPC1 1755/4885ALDH1A1 115/4885

“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.