SCHEMBL2003147

SCHEMBL2003147

CC1CCN(S(=O)(=O)N2CCOc3ncc(C(=O)NC(C)(C)CO)cc32)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 2/20 0.43
DGAT2 Q96PD7 2/20 0.36
KIF18A Q8NI77 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 3/20 0.33
NPC1 O15118 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
ATM Q13315 1/20 0.33
GABRA5 P31644 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
ADRB3 P13945 2/20 0.33
RORC P51449 1/20 0.33

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
SCHEMBL2001311 0.93 CPT1A (0.43) CPT1AKMT2AMEN1LMNANPC1
SCHEMBL2003068 0.93 CPT1A (0.44) CPT1ADGAT2KIF18ANPC1RAB9A
SCHEMBL2001898 0.93 CPT1A (0.43) CPT1ADGAT2KIF18ANPC1RAB9A
SCHEMBL2002327 0.91 CPT1A (0.42) CPT1ADGAT2KIF18ANPC1RAB9A
SCHEMBL2002514 0.91 CPT1A (0.45) CPT1AKMT2AMEN1LMNANPC1
SCHEMBL2003381 0.91 CPT1A (0.45) CPT1ADGAT2KIF18ALMNANPC1
SCHEMBL2002740 0.90 CPT1A (0.44) CPT1ADGAT2KIF18ALMNANPC1
SCHEMBL2003063 0.89 CPT1A (0.45) CPT1ADGAT2NPC1RAB9AATM
SCHEMBL2003683 0.88 CPT1A (0.42) CPT1AKMT2AMEN1LMNANPC1
SCHEMBL2005988 0.87 CPT1A (0.42) CPT1ADGAT2KIF18ANPC1RAB9A

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 3067/4885DGAT2 3570/4885KIF18A 4651/4885

“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.