SCHEMBL14959564

SCHEMBL14959564

COC(=O)N1Cc2ccc(OCCN3CCOCC3)cc2C1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 5/20 0.71
MGLL Q99685 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 1/20 0.53
KDM4E B2RXH2 4/20 0.52
ALDH1A1 P00352 3/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 1/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
HRH3 Q9Y5N1 3/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL14959462 0.94 ABHD6 (0.64) ABHD6MGLLALDH1A1HRH3
SCHEMBL11934330 0.90 ABHD6 (0.70) ABHD6MGLLSMN1; SMN2GAAKDM4E
SCHEMBL11929929 0.88 ABHD6 (0.70) ABHD6MGLLSMN1; SMN2GAAKDM4E
SCHEMBL13559930 0.87 ABHD6 (0.69) ABHD6MGLLSMN1; SMN2GAAKDM4E
SCHEMBL12187762 0.84 ABHD6 (0.63) ABHD6KDM4EALDH1A1HRH3
SCHEMBL20983811 0.84 ABHD6 (0.71) ABHD6MGLLSMN1; SMN2GAAKDM4E
SCHEMBL20983874 0.83 ABHD6 (1.00) ABHD6MGLL
SCHEMBL11929932 0.83 ABHD6 (0.63) ABHD6MGLLALDH1A1HRH3
SCHEMBL13559929 0.81 ABHD6 (0.61) ABHD6SMN1; SMN2KDM4EALDH1A1HRH3
SCHEMBL4317469 0.78 HRH3 (0.60) ABHD6KDM4EALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2013-06-13 US disclosed
US-8445527-B2 Organic compounds and their uses NOVARTIS AG (CH) 2013-05-21 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-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, HAVCR2, CPT1A ABHD6 1766/4885MGLL 574/4885SMN1; SMN2 1149/4885

“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.