SCHEMBL2024952

SCHEMBL2024952

CC(C)(C)NC(=O)c1cnc2c(c1)N(C(=O)O)CCO2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 2/20 0.41
HPGDS O60760 1/20 0.40
MAPT P10636 2/20 0.35
POLB P06746 1/20 0.35
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GRM5 P41594 2/20 0.32
EGLN1 Q9GZT9 1/20 0.32
P4HTM Q9NXG6 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
SLC22A8 Q8TCC7 1/20 0.32
SLC22A12 Q96S37 1/20 0.32
ATR Q13535 1/20 0.32
ATRIP Q8WXE1 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
JAK3 P52333 1/20 0.32
GABRA5 P31644 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL2000511 0.86 HPGDS (0.42) CPT1AHPGDSMAPTPOLB
SCHEMBL13670321 0.85 CPT1A (0.42) CPT1AHPGDSMAPTPOLBMEN1
SCHEMBL2000503 0.80 CPT1A (0.47) CPT1AHPGDSMAPTPOLB
SCHEMBL2001541 0.79 CPT1A (0.46) CPT1AHPGDSMAPTPOLB
SCHEMBL2001102 0.79 CPT1A (0.56) CPT1A
SCHEMBL2003304 0.78 CPT1A (0.47) CPT1AHPGDSPOLBMEN1KMT2A
SCHEMBL2002310 0.77 CPT1A (0.47) CPT1AHPGDSPOLBMEN1KMT2A
SCHEMBL2006076 0.77 CPT1A (0.47) CPT1AHPGDSCNR2
SCHEMBL2001654 0.77 CPT1A (0.45) CPT1AHPGDSMAPTPOLBMEN1
SCHEMBL2005529 0.77 CPT1A (0.51) CPT1AHPGDSMAPTPOLBMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960377-B2 Substituted pyridoxazines CARA THERAPEUTICS, INC. (US) 2011-06-14 US disclosed
US-20090247502-A1 SUBSTITUTED PYRIDOXAZINES CARA THERAPEUTICS, INC. (US) 2009-10-01 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 (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-20090247502-A1 SUBSTITUTED PYRIDOXAZINES CNR1, CNR2, TRPV1 CPT1A 3067/4885HPGDS 372/4885MAPT 1750/4885

“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.