SCHEMBL2002946

SCHEMBL2002946

CCN(CC)C(=O)c1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CCS2

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 3/20 0.51
CPT2 P23786 2/20 0.51
CPT1B Q92523 2/20 0.51
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
RORC P51449 1/20 0.47
RXFP1 Q9HBX9 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 6/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL1997927 0.90 CNR1 (0.61) CPT1ACPT2CPT1BCNR1CNR2
SCHEMBL2001124 0.89 CPT1A (0.54) CPT1ACPT2CPT1BCNR1CNR2
SCHEMBL1995905 0.87 CNR1 (0.49) CPT1ACPT2CPT1BCNR1CNR2
SCHEMBL2002912 0.84 CPT1A (0.63) CPT1ACPT2CPT1BCNR1CNR2
SCHEMBL21972125 0.81 KDM4E (0.61) CPT1ACPT2CPT1BCNR1CNR2
SCHEMBL1994888 0.79 HPGD (0.63) CPT1ACPT2CPT1BCNR1CNR2
SCHEMBL2002149 0.79 CPT1A (0.58) CPT1ACPT2CPT1BCNR1CNR2
SCHEMBL2003474 0.79 CPT1A (0.58) CPT1ACPT2CPT1BCNR1CNR2
SCHEMBL14987871 0.78 RORC (0.51) CPT1ACPT2CPT1BCNR1CNR2
SCHEMBL2001001 0.78 CPT2 (0.55) CPT1ACPT2CPT1BCNR1CNR2

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-7960376-B2 Benzo-fused heterocycles CARA THERAPEUTICS, INC. (US) 2011-06-14 US claimed
US-7960376-B2 Benzo-fused heterocycles CARA THERAPEUTICS, INC. (US) 2011-06-14 US disclosed
US-7960376-B2 Benzo-fused heterocycles CARA THERAPEUTICS, INC. (US) 2011-06-14 US disclosed
US-7960376-B2 Benzo-fused heterocycles CARA THERAPEUTICS, INC. (US) 2011-06-14 US disclosed
US-20090075973-A1 BENZO-FUSED HETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-03-19 US disclosed
US-20090075973-A1 BENZO-FUSED HETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-03-19 US disclosed
US-20090075973-A1 BENZO-FUSED HETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-03-19 US disclosed
WO-2009035997-A2 BENZO-FUSED HETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-03-19 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-20090075973-A1 BENZO-FUSED HETEROCYCLES CNR1, CNR2, TRPV1 CPT1A 1957/4885CPT2 3725/4885CPT1B 4018/4885

“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.