SCHEMBL1998755

SCHEMBL1998755

Cc1cccc(CS(=O)(=O)N2CCOc3ncc(C(=O)NC(C)(C)C)cc32)c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 3/20 0.44
GRM4 Q14833 1/20 0.40
ANO1 Q5XXA6 1/20 0.38
CPT1B Q92523 1/20 0.38
RORC P51449 6/20 0.37
TSHR P16473 1/20 0.36
ALDH1A1 P00352 1/20 0.35
ACKR3 P25106 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL2005529 0.91 CPT1A (0.51) CPT1ARORCTSHRALDH1A1ACKR3
SCHEMBL2002196 0.87 CPT1A (0.43) CPT1AGRM4CPT1BRORCALDH1A1
SCHEMBL2000867 0.85 CPT1A (0.49) CPT1ACPT1BRORC
SCHEMBL2003018 0.85 CPT1A (0.51) CPT1AGRM4CPT1BRORCACKR3
SCHEMBL2008932 0.85 CPT1A (0.44) CPT1AANO1RORC
SCHEMBL2000503 0.85 CPT1A (0.47) CPT1ARORC
SCHEMBL2006290 0.85 CPT1A (0.43) CPT1AGRM4RORC
SCHEMBL2001654 0.82 CPT1A (0.45) CPT1ACPT1BRORCALDH1A1MEN1
SCHEMBL2006990 0.81 CPT1A (0.44) CPT1ACPT1BRORCMEN1KMT2A
SCHEMBL2003096 0.81 CPT1A (0.49) CPT1ARORCACKR3

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 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

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 3067/4885GRM4 1013/4885ANO1 3882/4885

“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.