SCHEMBL2006076

SCHEMBL2006076

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

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 2/20 0.47
TDP1 Q9NUW8 1/20 0.37
HPGDS O60760 1/20 0.36
RORC P51449 3/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CNR2 P34972 4/20 0.35
CNR1 P21554 3/20 0.35
NAMPT P43490 1/20 0.35
LMNA P02545 2/20 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
SCHEMBL2003304 0.93 CPT1A (0.47) CPT1AHPGDSRORCCNR1LMNA
SCHEMBL2002310 0.92 CPT1A (0.47) CPT1AHPGDSRORCSMN1; SMN2CNR2
SCHEMBL1998105 0.91 CPT1A (0.45) CPT1AHPGDSRORCSMN1; SMN2CNR2
SCHEMBL1998249 0.91 CPT1A (0.46) CPT1AHPGDSRORC
SCHEMBL2007304 0.90 CPT1A (0.44) CPT1ATDP1CNR2CNR1NAMPT
SCHEMBL2002514 0.89 CPT1A (0.45) CPT1AHPGDSRORCMAPK1SMN1; SMN2
SCHEMBL2001296 0.89 CPT1A (0.47) CPT1AHPGDSRORC
SCHEMBL2005672 0.88 CPT1A (0.44) CPT1AHPGDSRORCCNR2CNR1
SCHEMBL2001377 0.88 CPT1A (0.44) CPT1AHPGDSRORCCNR2NAMPT
SCHEMBL1999479 0.87 CPT1A (0.47) CPT1AHPGDSRORCCNR2CNR1

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 3067/4885TDP1 3008/4885HPGDS 372/4885

“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.