SCHEMBL4833183

SCHEMBL4833183

CC(C)(C)c1ccc(C=NOCCCOc2ccc(C(=O)O)c(NC(=O)C=Cc3ccc(-c4ccccc4)cc3)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPM2 O94759 6/20 0.48
LTB4R Q15722 4/20 0.48
TRPA1 O75762 2/20 0.46
MAPT P10636 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TRPV1 Q8NER1 4/20 0.45
TNIK Q9UKE5 1/20 0.45
TRPM8 Q7Z2W7 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
LMNA P02545 2/20 0.41

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
SCHEMBL4833179 1.00 TRPM2 (0.48) TRPM2LTB4RTRPA1MAPTNPC1
SCHEMBL4833501 1.00 TRPM2 (0.48) TRPM2LTB4RTRPA1MAPTNPC1
SCHEMBL4828886 0.94 TRPV1 (0.46) TRPM2LTB4RTRPA1MAPTNPC1
SCHEMBL4828867 0.94 TRPV1 (0.46) TRPM2LTB4RTRPA1MAPTNPC1
SCHEMBL4828878 0.94 TRPV1 (0.46) TRPM2LTB4RTRPA1MAPTNPC1
SCHEMBL4833874 0.90 PLK1 (0.47) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4833858 0.90 PLK1 (0.47) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4833312 0.84 PLK1 (0.52) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4833302 0.84 PLK1 (0.52) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4833885 0.84 ALDH1A1 (0.44) MAPTNPC1RAB9ASMN1; SMN2MEN1

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-7420083-B2 Substituted aryloximes WYETH (US) 2008-09-02 US claimed
US-20050070584-A1 Substituted aryloximes WYETH (US) 2005-03-31 US claimed
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
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 TRPM2 4568/4885LTB4R 732/4885TRPA1 2718/4885
US-20080293790-A1 SUBSTITUTED ARYL OXIMES HCCS, AOX1, TET2 TRPM2 4793/4885LTB4R 1339/4885TRPA1 4014/4885

“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.