SCHEMBL9848415

SCHEMBL9848415

N#CC(NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
HPGD P15428 1/20 0.53
CTRB1 P17538 1/20 0.51
HPGDS O60760 1/20 0.49
S1PR3 Q99500 2/20 0.47
S1PR4 O95977 1/20 0.47
CTSL P07711 4/20 0.46
CTSS P25774 2/20 0.46
CTSK P43235 2/20 0.46
CTSB P07858 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 2/20 0.45
ALDH1A1 P00352 1/20 0.45
EPHX2 P34913 1/20 0.45
RAB9A P51151 1/20 0.45
SLC1A2 P43004 1/20 0.45
HDAC1 Q13547 1/20 0.44

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
SCHEMBL7598651 0.83 TSHR (0.47) LMNAHPGDCTSSCTSKSMN1; SMN2
SCHEMBL10614257 0.83 KCNK3 (0.43) LMNAHPGDCTRB1HPGDSS1PR3
SCHEMBL11639107 0.80 TSHR (0.44) LMNAHPGDCTSSCTSKSMN1; SMN2
SCHEMBL14065364 0.80 ALDH1A1 (0.53) CTRB1CTSSCTSKALDH1A1
SCHEMBL10922453 0.79 SMN1; SMN2 (0.46) LMNAHPGDCTSLCTSSCTSK
SCHEMBL5236032 0.79 HTT (0.51) HPGDNPC1ALDH1A1RAB9A
SCHEMBL6607452 0.78 LMNA (0.61) LMNAHPGDCTRB1HPGDSS1PR3
SCHEMBL11249549 0.77 CTSS (0.48) LMNAHPGDCTSLCTSSCTSK
SCHEMBL15716728 0.77 CTSS (0.51) CTSLCTSSCTSKCTSBSMN1; SMN2
SCHEMBL7723710 0.76 CTSL (0.54) LMNAHPGDCTSLCTSSCTSK

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-20160237074-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC Foundation for Research Development (10 pp.) 2016-08-18 US disclosed
US-20130137728-A1 Compositions and Methods for the Treatment of Degenerative Diseases MUSC Foundation for Research and Development (US) 2013-05-30 US disclosed
EP-0432442-A1 ACAT inhibitors WARNER-LAMBERT COMPANY (US) 1991-06-19 EP 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 (2 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-20160237074-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS PCSK9, ACHE, CLN6 LMNA 98/4885HPGD 89/4885CTRB1 166/4885
US-20130137728-A1 Compositions and Methods for the Treatment of Degenerative Diseases REN, PCSK9, LIPA LMNA 246/4885HPGD 101/4885CTRB1 163/4885

“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.