SCHEMBL5270481

SCHEMBL5270481

CCOC(=O)C(=O)CC(=O)c1cncs1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
POLB P06746 1/20 0.40
ACACB O00763 3/20 0.40
PKM P14618 3/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 2/20 0.39
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CTDSP1 Q9GZU7 1/20 0.35
KDM4E B2RXH2 2/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CDC7 O00311 1/20 0.34
DBF4 Q9UBU7 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
KIF11 P52732 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL28488682 0.84 MGAM (0.44) ALDH1A1SMN1; SMN2ACACBPKMKMT2A
SCHEMBL4832523 0.81 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2ACACBPKMKMT2A
SCHEMBL290564 0.77 CDC7 (0.49) ALDH1A1SMN1; SMN2ACACBPKMKMT2A
SCHEMBL4836924 0.76 KMT2A (0.39) ALDH1A1SMN1; SMN2ACACBPKMKMT2A
SCHEMBL4836930 0.76 KMT2A (0.39) ALDH1A1SMN1; SMN2ACACBPKMKMT2A
SCHEMBL4840774 0.76 KMT2A (0.39) ALDH1A1SMN1; SMN2ACACBPKMKMT2A
Hydrochloric Acid SCHEMBL27599188 0.76 CDC7 (0.48) ALDH1A1SMN1; SMN2ACACBPKMKMT2A
SCHEMBL6128211 0.75
SCHEMBL1694502 0.74 ERCC5 (0.61) ALDH1A1SMN1; SMN2POLBKMT2AMEN1
SCHEMBL14953364 0.73 KMT2A (0.44) ACACBKMT2ARAB9ATDP1KIF11

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
US-20070254881-A1 Pyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
CN-101001852-A Pyrazole derivatives DAIICHI SEIYAKU CO (JP) 2007-07-18 CN disclosed
EP-1785418-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-16 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-20070254881-A1 Pyrazole Derivative PTGER1, PTGS1, PTGER2 ALDH1A1 111/4885SMN1; SMN2 3490/4885POLB 4340/4885

“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.