SCHEMBL4834529

SCHEMBL4834529

C=CCOc1ccc(C(=O)OC)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.47
FLT3 P36888 1/20 0.47
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAOB P27338 1/20 0.43
GAA P10253 3/20 0.43
TSHR P16473 2/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MAPT P10636 2/20 0.42
POLB P06746 2/20 0.42
PTPN1 P18031 2/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ABL1 P00519 1/20 0.41
ADRA2A P08913 1/20 0.40

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
SCHEMBL5376581 0.87 BLM (0.50) BLMFLT3ALDH1A1SMN1; SMN2LMNA
SCHEMBL13924205 0.85 FLT3 (0.55) BLMFLT3ALDH1A1SMN1; SMN2LMNA
SCHEMBL3953525 0.84 CA12 (0.57) BLMFLT3ALDH1A1SMN1; SMN2LMNA
SCHEMBL8875743 0.84 GAA (0.46) FLT3ALDH1A1SMN1; SMN2LMNAMAOB
SCHEMBL27726630 0.83 BLM (0.47) BLMFLT3ALDH1A1SMN1; SMN2LMNA
SCHEMBL21447016 0.82 TDP1 (0.51) ALDH1A1SMN1; SMN2GAANPC1RAB9A
SCHEMBL5466042 0.81 CA12 (0.53) BLMFLT3ALDH1A1SMN1; SMN2LMNA
SCHEMBL7272605 0.80 GAA (0.59) BLMFLT3ALDH1A1SMN1; SMN2LMNA
SCHEMBL34470576 0.80 AGER (0.48) BLMFLT3ALDH1A1SMN1; SMN2LMNA
SCHEMBL27367633 0.80 BLM (0.45) BLMFLT3ALDH1A1SMN1; SMN2LMNA

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-20080293790-A1 SUBSTITUTED ARYL OXIMES WYETH (US) 2008-11-27 US disclosed
US-7420083-B2 Substituted aryloximes WYETH (US) 2008-09-02 US disclosed
EP-1663189-A1 4-(PHENYL-ETHYLIDENEAMINOXY-PROPOXY)-PHENYL-ACETIC ACID DERIVATIVES AND RELATED COMPOUNDS AS PAI-1 INHIBITORS FOR THE TREATMENT OF IMPAIREMENT OF THE FIBRINOLYTIC SYSTEM AND OF THROMBISIS Wyeth (US) 2006-06-07 EP disclosed
WO-2005030193-A1 4-(PHENYL-ETHYLIDENEAMINOXY-PROPOXY) -PHENYL-ACETIC ACID DERIVATIVES AND RELATED COMPOUNDS AS PAI-1 INHIBITORS FOR THE TREATMENT OF IMPAIRMENT OF THE FIBRINOLYTIC SYSTEM AND OF THROMBOSIS WYETH (US) 2005-04-07 WO disclosed
US-20050070584-A1 Substituted aryloximes WYETH (US) 2005-03-31 US 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-20050070584-A1 Substituted aryloximes AHR, NQO1, AOX1 BLM 1329/4885FLT3 191/4885ALDH1A1 269/4885
US-20080293790-A1 SUBSTITUTED ARYL OXIMES HCCS, AOX1, TET2 BLM 1145/4885FLT3 125/4885ALDH1A1 211/4885

“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.