SCHEMBL2003304

SCHEMBL2003304

CC(C)(C)NC(=O)c1cnc2c(c1)N(S(=O)(=O)N1CCCC1)CCO2

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 2/20 0.47
HPGDS O60760 1/20 0.36
RORC P51449 4/20 0.36
HTT P42858 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
USP9X Q93008 1/20 0.32
LMNA P02545 2/20 0.32
CNR1 P21554 1/20 0.32

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
SCHEMBL2002310 0.99 CPT1A (0.47) CPT1AHPGDSRORCHTTMEN1
SCHEMBL2006076 0.93 CPT1A (0.47) CPT1AHPGDSRORCLMNACNR1
SCHEMBL1998249 0.92 CPT1A (0.46) CPT1AHPGDSRORCPOLBNPC1
SCHEMBL2000954 0.91 CPT1A (0.44) CPT1AHPGDSRORCL3MBTL1NPC1
SCHEMBL1998105 0.90 CPT1A (0.45) CPT1AHPGDSRORCNPC1RAB9A
SCHEMBL2001296 0.90 CPT1A (0.47) CPT1AHPGDSRORCNPC1RAB9A
SCHEMBL2002514 0.90 CPT1A (0.45) CPT1AHPGDSRORCMEN1KMT2A
SCHEMBL2003381 0.90 CPT1A (0.45) CPT1ARORCHTTNPC1RAB9A
SCHEMBL2002740 0.89 CPT1A (0.44) CPT1ARORCHTTNPC1RAB9A
SCHEMBL2005672 0.89 CPT1A (0.44) CPT1AHPGDSRORCCNR1

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 3067/4885HPGDS 372/4885RORC 122/4885

“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.