SCHEMBL4870701

SCHEMBL4870701

O=C(NCC1(C(=O)O)CCCC1)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HTT P42858 1/20 0.51
CTSL P07711 1/20 0.51
CTSB P07858 1/20 0.51
CTSS P25774 1/20 0.51
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TGM2 P21980 1/20 0.46
MGLL Q99685 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
PLAU P00749 1/20 0.45
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL4861409 0.99 CTSL (0.53) LMNASMN1; SMN2HTTCTSLCTSB
SCHEMBL3647693 0.99 CTSL (0.53) LMNASMN1; SMN2HTTCTSLCTSB
SCHEMBL10152341 0.87 CTSL (0.51) LMNASMN1; SMN2HTTCTSLCTSB
SCHEMBL4867430 0.87 LMNA (0.50) LMNASMN1; SMN2HTTCTSLCTSB
SCHEMBL15073439 0.86 LMNA (0.46) LMNASMN1; SMN2HTTCTSLCTSB
SCHEMBL4870656 0.85 ALDH1A1 (0.48) LMNASMN1; SMN2HTTCTSLCTSB
SCHEMBL6240346 0.85 ALDH1A1 (0.48) LMNASMN1; SMN2HTTCTSLCTSB
Hydrochloric Acid SCHEMBL15055405 0.85 LMNA (0.45) LMNASMN1; SMN2HTTCTSLCTSB
SCHEMBL22035074 0.85 LMNA (0.57) LMNASMN1; SMN2HTTCTSLCTSB
SCHEMBL6203374 0.84 CTSL (0.51) LMNASMN1; SMN2HTTCTSLCTSB

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-7332485-B2 Peptide deformylase inhibitors SMITHKLINE BEECHAM CORP (US) 2008-02-19 US disclosed
US-20060160802-A1 Peptide deformylase inhibitors GLAXO GROUP LIMITED 2006-07-20 US disclosed
WO-2005005456-A2 PEPTIDE DEFORMYLASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-01-20 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-20060160802-A1 Peptide deformylase inhibitors PDF, PEPD, DPEP1 LMNA 2515/4885SMN1; SMN2 2654/4885HTT 2931/4885

“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.