SCHEMBL15068613

SCHEMBL15068613

CCc1cccc2oc(=O)c(N)c(C3CCNC3)c12

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.39
KDM4E B2RXH2 4/20 0.35
GAA P10253 4/20 0.35
MAPT P10636 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
ALDH1A1 P00352 1/20 0.33
PARP1 P09874 1/20 0.33
EED O75530 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
SCHEMBL15068634 0.85 HTR2C (0.38) KDM4EGAAMAPTHTR2AHTR2C
SCHEMBL16671455 0.82 SLC6A2 (0.35) ELANEKDM4EGAAMAPTHSD17B10
SCHEMBL15068898 0.77 HTR2C (0.43) KDM4EGAAMAPTHTR2AHTR2C
SCHEMBL9502514 0.71 ELANE (0.49) ELANEKDM4EGAAMAPTHSD17B10
SCHEMBL28351931 0.68 ELANE (0.46) ELANEKDM4EGAAMAPTHSD17B10
SCHEMBL15068579 0.67 BCHE (0.35) MAPTHSD17B10
SCHEMBL16671710 0.65 SLC6A2 (0.38) ELANEKDM4EGAAMAPTHSD17B10
SCHEMBL15068512 0.63 GABRA1 (0.40) HTR2C
SCHEMBL15068460 0.63 SLC6A2 (0.41)
SCHEMBL15068615 0.62 GAA (0.47) KDM4EGAAMAPTHSD17B10ALDH1A1

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 5 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-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
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

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 ELANE 1265/4885KDM4E 829/4885GAA 447/4885

“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.