SCHEMBL2007206

SCHEMBL2007206

O=C(O)c1cnc2c(c1)N(S(=O)(=O)c1cccc3ccccc13)CCO2

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 3/20 0.51
HTR6 P50406 4/20 0.48
RORC P51449 4/20 0.41
TSHR P16473 2/20 0.41
P4HTM Q9NXG6 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MGAM O43451 1/20 0.39
CNR1 P21554 2/20 0.39
GBA1 P04062 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CPT2 P23786 1/20 0.37

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
SCHEMBL2004346 0.87 CPT1A (0.53) CPT1AHTR6RORCP4HTMMEN1
SCHEMBL2010810 0.85 CPT1A (0.52) CPT1AHTR6RORCTSHRALDH1A1
SCHEMBL2007284 0.84 CPT1A (0.52) CPT1AHTR6RORCMEN1KMT2A
SCHEMBL2007152 0.82 MCL1 (0.54) CPT1ARORCALDH1A1CPT2
SCHEMBL2004298 0.81 CPT1A (0.53) CPT1ARORCKMT2ACPT2
SCHEMBL2005083 0.78 CPT1A (0.59) CPT1AHTR6RORCCPT2
SCHEMBL2001658 0.78 CPT1A (0.50) CPT1AHTR6RORCGBA1CPT2
SCHEMBL2001468 0.78 RORC (0.51) CPT1AHTR6RORCNPSR1CPT2
SCHEMBL2002774 0.78 CPT1A (0.49) CPT1ARORCMEN1KMT2ACPT2
SCHEMBL2000702 0.78 CPT1A (0.61) CPT1ARORCCPT2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 3067/4885HTR6 503/4885RORC 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.