SCHEMBL2002415

SCHEMBL2002415

CC(C)(CO)CNC(=O)c1cnc2c(c1)N(S(=O)(=O)N1CC(F)(F)C1)CCO2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 2/20 0.43
MAPT P10636 1/20 0.35
NAMPT P43490 1/20 0.34
RORC P51449 4/20 0.33
GABRA5 P31644 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CNR2 P34972 5/20 0.33
CNR1 P21554 1/20 0.32
PIK3CD O00329 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 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
SCHEMBL2000103 0.89 CPT1A (0.43) CPT1AMAPTNAMPTL3MBTL1CNR2
SCHEMBL2003143 0.88 CPT1A (0.42) CPT1AMAPTNAMPTRORCGABRA5
SCHEMBL2001100 0.88 CPT1A (0.44) CPT1ANAMPTRORCCNR2CNR1
SCHEMBL2003873 0.86 CPT1A (0.41) CPT1AMAPTNAMPTRORCGABRA5
SCHEMBL1997796 0.86 CPT1A (0.43) CPT1AMAPTRORCGABRA5L3MBTL1
SCHEMBL2003683 0.86 CPT1A (0.42) CPT1AMAPTGABRA5L3MBTL1CNR2
SCHEMBL1999479 0.86 CPT1A (0.47) CPT1ANAMPTRORCCNR2CNR1
SCHEMBL1999612 0.84 CPT1A (0.44) CPT1ANAMPTRORCCNR2HDAC3
SCHEMBL2000925 0.83 SMN1; SMN2 (0.45) CPT1AMAPTL3MBTL1
SCHEMBL2002375 0.83 CPT1A (0.44) CPT1AMAPTL3MBTL1HDAC6

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 3067/4885MAPT 1750/4885NAMPT 1519/4885

“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.