SCHEMBL2000103

SCHEMBL2000103

CC(C)(CO)CNC(=O)c1cnc2c(c1)N(S(=O)(=O)N1CCOCC1)CCO2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 2/20 0.43
CNR2 P34972 2/20 0.41
CNR1 P21554 1/20 0.41
NAMPT P43490 1/20 0.37
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.37
PIK3CD O00329 1/20 0.37
MAPT P10636 1/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 3/20 0.36
RAB9A P51151 2/20 0.35
MEN1 O00255 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL2003143 0.92 CPT1A (0.42) CPT1ACNR2CNR1NAMPTALDH1A1
SCHEMBL1997796 0.90 CPT1A (0.43) CPT1ACNR2CNR1PIK3CDMAPT
SCHEMBL2003683 0.90 CPT1A (0.42) CPT1ACNR2ALDH1A1PKMMAPT
SCHEMBL2003873 0.89 CPT1A (0.41) CPT1ACNR2NAMPTMAPTL3MBTL1
SCHEMBL2002415 0.89 CPT1A (0.43) CPT1ACNR2CNR1NAMPTPIK3CD
SCHEMBL2002375 0.87 CPT1A (0.44) CPT1AMAPTL3MBTL1
SCHEMBL2000925 0.86 SMN1; SMN2 (0.45) CPT1AALDH1A1MAPTNPC1KMT2A
SCHEMBL2006076 0.85 CPT1A (0.47) CPT1ACNR2CNR1NAMPTLMNA
SCHEMBL2007304 0.83 CPT1A (0.44) CPT1ACNR2CNR1NAMPTLMNA
SCHEMBL2002962 0.82 CPT1A (0.41) CPT1ACNR2CNR1ALDH1A1PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960377-B2 Substituted pyridoxazines CARA THERAPEUTICS, INC. (US) 2011-06-14 US claimed
US-7960377-B2 Substituted pyridoxazines CARA THERAPEUTICS, INC. (US) 2011-06-14 US disclosed
US-7960377-B2 Substituted pyridoxazines CARA THERAPEUTICS, INC. (US) 2011-06-14 US disclosed
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
US-20090247502-A1 SUBSTITUTED PYRIDOXAZINES CARA THERAPEUTICS, INC. (US) 2009-10-01 US disclosed
US-20090247502-A1 SUBSTITUTED PYRIDOXAZINES CARA THERAPEUTICS, INC. (US) 2009-10-01 US disclosed
WO-2009120660-A2 SUBSTITUTED PYRIDOXAZINES CARA THERAPEUTICS, INC. (US) 2009-10-01 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-20090247502-A1 SUBSTITUTED PYRIDOXAZINES CNR1, CNR2, TRPV1 CPT1A 3067/4885CNR2 2/4885CNR1 1/4885

“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.