SCHEMBL1999198

SCHEMBL1999198

CC(C)(CO)NC(=O)c1cnc2c(c1)N(S(=O)(=O)c1ccc(Cl)c(Cl)c1)CCO2

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 6/20 0.49
RORC P51449 7/20 0.47
CYP2C9 P11712 1/20 0.37
CPT1B Q92523 3/20 0.37
CPT2 P23786 2/20 0.37
HTT P42858 1/20 0.37
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
POLB P06746 1/20 0.36
KIF18A Q8NI77 1/20 0.35

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
SCHEMBL2003015 0.93 RORC (0.53) CPT1ARORCCPT1BCPT2MEN1
SCHEMBL1999577 0.91 CPT1A (0.51) CPT1ARORCCYP2C9CPT1BCPT2
SCHEMBL2000423 0.91 CPT1A (0.57) CPT1ARORCCPT1BCPT2LMNA
SCHEMBL2004061 0.89 CPT1A (0.46) CPT1ARORCMEN1TSHRKMT2A
SCHEMBL1998580 0.88 CPT1A (0.48) CPT1ARORCCYP2C9CPT1BCPT2
SCHEMBL2006542 0.88 CPT1A (0.53) CPT1ARORCCYP2C9CPT1BCPT2
SCHEMBL2005029 0.87 CPT1A (0.46) CPT1ARORCCYP2C9HTT
SCHEMBL2002229 0.86 CPT1A (0.49) CPT1ARORCCYP2C9CPT1BCPT2
SCHEMBL2000318 0.85 RORC (0.49) CPT1ARORCCYP2C9CPT1BCPT2
SCHEMBL2003554 0.84 CPT1A (0.53) CPT1ARORCCYP2C9CPT1BCPT2

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 3067/4885RORC 122/4885CYP2C9 346/4885

“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.