SCHEMBL4255873

SCHEMBL4255873

COC(=O)c1ccc(C(=O)NCCOCCOCCNC(=O)OC(C)(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.52
POLB P06746 2/20 0.51
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.45
CA2 P00918 3/20 0.45
HPGD P15428 1/20 0.45
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA9 Q16790 1/20 0.43
NPC1 O15118 1/20 0.43
CASP3 P42574 1/20 0.43
RAB9A P51151 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
ADRB2 P07550 1/20 0.43
HTR1A P08908 1/20 0.43
DGAT1 O75907 1/20 0.43
SUCNR1 Q9BXA5 1/20 0.43
IDO1 P14902 1/20 0.43

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
SCHEMBL18086456 0.88 NPC1 (0.56) SMN1; SMN2POLBALDH1A1CA2HPGD
SCHEMBL4257896 0.88 SMN1; SMN2 (0.57) SMN1; SMN2POLBALDH1A1MAPTCA2
SCHEMBL30905400 0.88 POLB (0.67) POLBALDH1A1MAPTCA2CA12
SCHEMBL22938995 0.87 SMN1; SMN2 (0.52) SMN1; SMN2POLBALDH1A1MAPTCA2
SCHEMBL22939048 0.87 SMN1; SMN2 (0.52) SMN1; SMN2POLBALDH1A1MAPTCA2
SCHEMBL22939676 0.87 SMN1; SMN2 (0.52) SMN1; SMN2POLBALDH1A1MAPTCA2
SCHEMBL22939679 0.87 SMN1; SMN2 (0.52) SMN1; SMN2POLBALDH1A1MAPTCA2
SCHEMBL29780254 0.87 SMN1; SMN2 (0.52) SMN1; SMN2POLBALDH1A1MAPTCA2
SCHEMBL21113585 0.86 SMN1; SMN2 (0.72) SMN1; SMN2POLBALDH1A1HPGDNPC1
SCHEMBL16103590 0.86 CA2 (0.45) SMN1; SMN2POLBALDH1A1MAPTCA2

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-20090170906-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 US disclosed
US-20090170906-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 US disclosed
US-20090170906-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 US disclosed
EP-1819671-A2 HCV INHIBITORS WITH CARBAZOLE STRUCTURE SmithKline Beecham Corporation (US) 2007-08-22 EP disclosed
WO-2006118607-A2 HCV INHIBITORS WITH CARBAZOLE STRUCTURE SMITHKLINE BEECHAM CORPORATION (US) 2006-11-09 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-20090170906-A1 HCV INHIBITORS HAVCR2, MAVS, EIF2AK2 SMN1; SMN2 4443/4885POLB 3538/4885ALDH1A1 1558/4885

“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.