SCHEMBL2006852

SCHEMBL2006852

COc1ccc(S(=O)(=O)N2CCOc3ncc(C(=O)O)cc32)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 10/20 0.61
LMNA P02545 2/20 0.47
RORC P51449 3/20 0.47
CPT2 P23786 7/20 0.46
CPT1B Q92523 6/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
HPGD P15428 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL2005487 0.89 CPT1A (0.57) CPT1ALMNARORCCPT2CPT1B
SCHEMBL2005185 0.88 CPT1A (0.51) CPT1ARORCCPT2CPT1BSMN1; SMN2
SCHEMBL2002412 0.85 RORC (0.57) CPT1ALMNARORCCPT2CPT1B
SCHEMBL12569922 0.85 CPT1A (0.54) CPT1ALMNARORCSMN1; SMN2MEN1
SCHEMBL2009465 0.85 CPT1A (0.57) CPT1ALMNARORCCPT2CPT1B
SCHEMBL2000423 0.85 CPT1A (0.57) CPT1ALMNARORCCPT2CPT1B
Potassium SCHEMBL751515 0.84 CPT1A (0.80) CPT1ACPT2CPT1B
SCHEMBL751513 0.84 CPT1A (0.80) CPT1ACPT2CPT1B
SCHEMBL2001536 0.84 RORC (0.58) CPT1ARORCCPT2CPT1BMEN1
SCHEMBL2005083 0.81 CPT1A (0.59) CPT1ARORCCPT2CPT1B

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 3067/4885LMNA 3572/4885RORC 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.