SCHEMBL15065669

SCHEMBL15065669

CC(=O)c1cc2ccc(OCCO)cc2oc1=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.69
GAA P10253 2/20 0.69
ALDH1A1 P00352 2/20 0.69
HPGD P15428 1/20 0.69
HSD11B1 P28845 5/20 0.63
CA12 O43570 3/20 0.60
CA1 P00915 2/20 0.60
CA9 Q16790 2/20 0.60
CA2 P00918 1/20 0.60
CA4 P22748 1/20 0.60
CA5A P35218 1/20 0.60
CA7 P43166 1/20 0.60
CA5B Q9Y2D0 1/20 0.60
MAOA P21397 6/20 0.59
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
S1PR4 O95977 1/20 0.58
GLA P06280 1/20 0.58
MAPT P10636 1/20 0.58
MIF P14174 1/20 0.58

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
SCHEMBL4402618 0.91 MAOB (0.65) MAOBGAAALDH1A1HPGDHSD11B1
SCHEMBL28918549 0.90 MAOB (0.72) MAOBGAAALDH1A1HPGDHSD11B1
SCHEMBL16674827 0.90 MAOB (0.69) MAOBGAAALDH1A1HPGDHSD11B1
SCHEMBL30110285 0.88 MAOB (0.71) MAOBGAAALDH1A1HPGDHSD11B1
SCHEMBL28823131 0.88 MAOB (0.67) MAOBGAAALDH1A1HPGDHSD11B1
SCHEMBL28918835 0.87 MAOB (0.77) MAOBGAAALDH1A1HPGDHSD11B1
SCHEMBL28823163 0.87 MAOB (0.66) MAOBGAAALDH1A1HPGDHSD11B1
SCHEMBL22059557 0.86 ALDH1A1 (0.72) MAOBGAAALDH1A1HPGDHSD11B1
SCHEMBL28823087 0.86 MAOB (0.64) MAOBGAAALDH1A1HPGDHSD11B1
SCHEMBL18154611 0.85 MAOB (0.64) MAOBGAAALDH1A1HPGDHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE47689-E1 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2019-11-05 US disclosed
US-RE47689-E1 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2019-11-05 US disclosed
EP-2797592-B1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS INC (US) 2019-08-28 EP disclosed
EP-2797592-B1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS INC (US) 2019-08-28 EP disclosed
US-9617268-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2017-04-11 US disclosed
US-9617268-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2017-04-11 US disclosed
US-9617268-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2017-04-11 US disclosed
US-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY F. HOFFMANN-LA ROCHE AG (CH) 2015-04-30 US disclosed
US-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY F. HOFFMANN-LA ROCHE AG (CH) 2015-04-30 US disclosed
US-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY F. HOFFMANN-LA ROCHE AG (CH) 2015-04-30 US disclosed
EP-2797592-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC Therapeutics, Inc. (US) 2014-11-05 EP disclosed
WO-2013101974-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS, INC. (US) 2013-07-04 WO disclosed
WO-2013101974-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS, INC. (US) 2013-07-04 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-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, RBM17, RBM22 MAOB 1733/4885GAA 447/4885ALDH1A1 1006/4885

“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.