SCHEMBL4096330

SCHEMBL4096330

CCCNC(=O)c1ccsc1NC(=O)C1C(C)(C)C1(C)C

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.48
PTK2 Q05397 1/20 0.42
MAPK10 P53779 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 2/20 0.41
TSHR P16473 1/20 0.41
POLB P06746 3/20 0.40
CRBN Q96SW2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
THRB P10828 1/20 0.40
RECQL P46063 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ABCC1 P33527 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL4080542 0.78 PTPN2 (0.60) CNR2PTK2MAPK10SMN1; SMN2MEN1
SCHEMBL3798512 0.77 RPS6KB1 (0.52) CNR2MAPK10SMN1; SMN2MEN1KMT2A
SCHEMBL4080867 0.76 CNR2 (0.52) CNR2MAPK10SMN1; SMN2L3MBTL1POLB
SCHEMBL163032 0.76 L3MBTL1 (0.47) SMN1; SMN2KMT2AL3MBTL1HTTTSHR
SCHEMBL4095531 0.76 ALOX15 (0.65) CNR2
SCHEMBL4086750 0.73 CNR2 (0.53) CNR2SMN1; SMN2POLBALDH1A1GAA
SCHEMBL7491639 0.72 KMT2A (0.50) SMN1; SMN2MEN1KMT2AL3MBTL1HTT
SCHEMBL4084751 0.72 CNR2 (0.58) CNR2MEN1KMT2APOLBALDH1A1
SCHEMBL10272694 0.70 CHRNB2 (0.43) CNR2MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL8114605 0.69 ABCC1 (0.60) PTK2SMN1; SMN2KMT2AALDH1A1GAA

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-8338623-B2 N-{3-[(2,5-dimethylmorpholin-4-yl)carbonyl]-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl}hexahydro-2,5-methanopentalene-3a(1H)-carboxamide; CB2 receptors ligand; antiinflammatory, analgesic agent; autoimmune diseases; neuroprotectants ABBVIE INC. (US) 2012-12-25 US disclosed
US-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-01-15 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-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, GPR18 CNR2 2/4885PTK2 3094/4885MAPK10 1787/4885

“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.