SCHEMBL1994708

SCHEMBL1994708

COc1ccc(C)cc1S(=O)(=O)n1ccc2c3c(c(OC)cc21)OCCNC3(C)OC(=O)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 2/20 0.37
CPT1A P50416 2/20 0.37
CPT1B Q92523 2/20 0.37
RECQL P46063 1/20 0.36
KMT2A Q03164 2/20 0.35
GAA P10253 2/20 0.35
USP2 O75604 1/20 0.35
HTR6 P50406 2/20 0.34
HSD17B10 Q99714 1/20 0.34
FABP4 P15090 2/20 0.34
TSHR P16473 3/20 0.34
MAPK1 P28482 1/20 0.33
PPARG P37231 2/20 0.32
PPARD Q03181 2/20 0.32
PPARA Q07869 2/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL1997135 0.89 FABP4 (0.39) HTR6FABP4
SCHEMBL1998595 0.87 HTR6 (0.34) CPT2CPT1ACPT1BHTR6FABP4
SCHEMBL2002914 0.86 HTR6 (0.40) HTR6FABP4
Trifluoroacetic Acid SCHEMBL1994705 0.77 CPT2 (0.39) CPT2CPT1ACPT1BRECQLKMT2A
SCHEMBL1997556 0.73 TSHR (0.42) CPT2CPT1ACPT1BRECQLKMT2A
SCHEMBL1994437 0.72 HTR6 (0.46) GAAHTR6FABP4MAPK1
SCHEMBL1997745 0.68 TSHR (0.39) CPT2CPT1ACPT1BRECQLKMT2A
Trifluoroacetic Acid SCHEMBL3618419 0.68 CPT2 (0.47) CPT2CPT1ACPT1BRECQLKMT2A
SCHEMBL3618421 0.68 FABP4 (0.44) CPT2CPT1ACPT1BRECQLKMT2A
Trifluoroacetic Acid SCHEMBL3619410 0.67 HTR6 (0.59) CPT2CPT1ACPT1BHTR6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960374-B2 e.g. 2,5-methylene-9-(phenylsulfonyl)-1,2,3,4,5,9-hexahydro[1,5]oxazocino[3,2-e]indole; serotonin receptors antagonist or partial agonist; metabolic diseases, e.g. obesity, insulin resisitance, type 2 diabetes, eating disorders; antidepressant, anxiolytic agent; cosmetics PROXIMAGEN LIMITED (GB) 2011-06-14 US disclosed
US-20080176829-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-07-24 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-20080176829-A1 Compounds HTR6, HTR1B, HTR1A CPT2 1489/4885CPT1A 484/4885CPT1B 953/4885

“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.