SCHEMBL4121932

SCHEMBL4121932

COc1ccc(O)c(C(=O)C(C)C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
HPGD P15428 4/20 0.51
ALDH1A1 P00352 4/20 0.51
CYP3A4 P08684 3/20 0.51
MAPK1 P28482 2/20 0.51
MEN1 O00255 6/20 0.51
KMT2A Q03164 6/20 0.51
MAPT P10636 5/20 0.51
KDM4E B2RXH2 5/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
HSD17B10 Q99714 3/20 0.51
LMNA P02545 2/20 0.51
TP53 P04637 2/20 0.51
ALOX12 P18054 2/20 0.51
ALOX15 P16050 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CYP1A2 P05177 1/20 0.50
PGR P06401 1/20 0.50
ADORA3 P0DMS8 1/20 0.50

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
SCHEMBL3639792 0.86 NPC1 (0.68) NPC1RAB9AHPGDALDH1A1CYP3A4
SCHEMBL13761323 0.82 MAPT (0.62) RAB9AHPGDALDH1A1MEN1KMT2A
SCHEMBL22133754 0.81 CA12 (0.59) ALDH1A1KDM4EGAARECQLDBH
SCHEMBL28093168 0.81 RAB9A (0.71) NPC1RAB9AHPGDALDH1A1CYP3A4
SCHEMBL16163247 0.81 HPGD (0.57) NPC1RAB9AHPGDALDH1A1CYP3A4
SCHEMBL9203943 0.81 NOS2 (0.50) NPC1RAB9AHPGDALDH1A1CYP3A4
SCHEMBL128781 0.79 CA1 (0.61) NPC1RAB9AHPGDALDH1A1CYP3A4
SCHEMBL29431885 0.79 CA1 (0.61) NPC1RAB9AHPGDALDH1A1CYP3A4
SCHEMBL29445806 0.79 ALDH1A1 (0.72) NPC1RAB9AHPGDALDH1A1CYP3A4
SCHEMBL6856233 0.79 NPC1 (0.58) NPC1RAB9AHPGDALDH1A1CYP3A4

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-20090221596-A1 Substtituted aryl oximes BAYER CROPSCIENCE AG (DE) 2009-09-03 US disclosed
US-20090221596-A1 Substtituted aryl oximes BAYER CROPSCIENCE AG (DE) 2009-09-03 US disclosed
US-20090221596-A1 Substtituted aryl oximes BAYER CROPSCIENCE AG (DE) 2009-09-03 US disclosed
EP-1883622-A1 SUBSTITUTED ARYL OXIMES Bayer CropScience Aktiengesellschaft (DE) 2008-02-06 EP disclosed
WO-2007090434-A1 SUBSTITUTED ARYL OXIMES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-08-16 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-20090221596-A1 Substtituted aryl oximes CYP1A1, PRDX1, CYP1A2 NPC1 3841/4885RAB9A 2004/4885HPGD 2666/4885

“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.