SCHEMBL15068898

SCHEMBL15068898

Cc1cccc2oc(=O)c(N)c(C3CCNCC3)c12

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.43
HTR2A P28223 1/20 0.39
HTR2B P41595 1/20 0.39
GAA P10253 4/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GABRA1 P14867 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35

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 0.92 HTR2C (0.38) HTR2CHTR2AHTR2BGAAMAPT
SCHEMBL16671710 0.81 SLC6A2 (0.38) HTR2AGAAMAPTHPGDL3MBTL1
SCHEMBL15068613 0.77 ELANE (0.39) HTR2CHTR2AHTR2BGAAMAPT
SCHEMBL15068512 0.77 GABRA1 (0.40) HTR2CBCHEACHEGABRA1GABRG2
SCHEMBL16671455 0.76 SLC6A2 (0.35) GAAMAPTKDM4EALDH1A1
SCHEMBL11308108 0.74 GAA (0.53) GAAMAPTHPGDL3MBTL1KDM4E
SCHEMBL4812115 0.73 GAA (0.48) GAAMAPTHPGDL3MBTL1KDM4E
SCHEMBL2716395 0.72 HTR2C (0.63) HTR2CHTR2A
Hydrochloric Acid SCHEMBL4518439 0.70 HTR2C (0.65) HTR2CGABRA1
SCHEMBL7966223 0.68 HTR2C (0.46) HTR2CHTR2ABCHEACHEGABRA1

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 HTR2C 3828/4885HTR2A 2715/4885HTR2B 3398/4885

“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.