SCHEMBL11893690

SCHEMBL11893690

CC([C@H]1CC[C@H](C(=O)O)CC1)n1c(=O)[nH]c2ccccc2c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ ALDH1A1 P00352 3/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ ADORA3 P0DMS8 1/20 0.43
▸ ADORA2A P29274 1/20 0.43
▸ ADORA2B P29275 1/20 0.43
▸ ADORA1 P30542 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ RNASEH1 O60930 1/20 0.43
▸ ERCC1 P07992 1/20 0.43
▸ ERCC5 P28715 1/20 0.43
▸ FEN1 P39748 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ ERCC4 Q92889 1/20 0.43
▸ KDM4E B2RXH2 3/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ MAPK10 P53779 1/20 0.41
▸ GCK P35557 2/20 0.40

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
SCHEMBL11893691 1.00 KMT2A (0.47) KMT2AL3MBTL1ALDH1A1MEN1ADORA3
SCHEMBL15399742 0.77 B3GNT2 (0.34) KMT2AL3MBTL1
SCHEMBL25335125 0.75 ALDH1A1 (0.55) KMT2AL3MBTL1ALDH1A1MEN1ADORA3
SCHEMBL31160877 0.75 ALDH1A1 (0.55) KMT2AL3MBTL1ALDH1A1MEN1ADORA3
SCHEMBL31160981 0.75 ALDH1A1 (0.55) KMT2AL3MBTL1ALDH1A1MEN1ADORA3
SCHEMBL1669092 0.73 MAPK10 (0.70) KMT2AALDH1A1MEN1KDM4EHSD17B10
SCHEMBL11893787 0.73 MAPK10 (0.70) KMT2AALDH1A1MEN1KDM4EHSD17B10
SCHEMBL2600725 0.73 ALDH1A1 (0.73) KMT2AL3MBTL1ALDH1A1MEN1ADORA3
SCHEMBL15399747 0.72 DGAT1 (0.41) —
SCHEMBL15399749 0.72 DGAT1 (0.41) —

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-8865704-B2 Wnt pathway antagonists SIENA BIOTECH S.P.A. (IT) 2014-10-21 — — US disclosed
EP-2485728-B1 WNT PATHWAY ANTAGONISTS SIENA BIOTECH SPA (IT) 2013-07-10 — — EP disclosed
US-20120196851-A1 WNT PATHWAY ANTAGONISTS SIENA BIOTECH S.P.A. (IT) 2012-08-02 — — 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-20120196851-A1 WNT PATHWAY ANTAGONISTS WNT1, WNT3A, CTNNB1 KMT2A 4271/4885L3MBTL1 3370/4885ALDH1A1 1797/4885

“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.

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