SCHEMBL4095727

SCHEMBL4095727

CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)C12CC3CC(CC1C3)C2

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.64
ALDH1A1 P00352 10/20 0.61
HPGD P15428 7/20 0.61
LMNA P02545 1/20 0.61
KDM4E B2RXH2 3/20 0.59
TP53 P04637 1/20 0.59
THRB P10828 1/20 0.59
GSTO1 P78417 1/20 0.58
MAPT P10636 7/20 0.57
NPSR1 Q6W5P4 3/20 0.57
GAA P10253 3/20 0.55
CYP1A2 P05177 2/20 0.55
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 2/20 0.55
HTT P42858 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
CYP3A4 P08684 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.50

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
SCHEMBL3800992 1.00 CNR2 (0.64) CNR2ALDH1A1HPGDLMNAKDM4E
SCHEMBL3737197 0.91 CNR2 (0.52) CNR2ALDH1A1HPGDLMNAKDM4E
SCHEMBL3749679 0.86 CNR2 (0.62) CNR2KDM4EMAPTNPSR1RAB9A
SCHEMBL4080887 0.84 ALOX15 (0.57) CNR2ALOX15
SCHEMBL3804151 0.84 ALOX15 (0.57) CNR2ALOX15
SCHEMBL4079925 0.83 MAPT (0.59) CNR2ALDH1A1HPGDLMNAKDM4E
SCHEMBL3648724 0.81 CNR2 (0.47) CNR2ALDH1A1HPGDLMNAKDM4E
SCHEMBL4091079 0.79 CHEK1 (0.54) CNR2ALOX15
SCHEMBL3756414 0.79 CNR2 (0.64) CNR2ALDH1A1HPGDLMNAKDM4E
SCHEMBL4083931 0.78 CNR2 (0.53) CNR2KDM4EMAPTNPSR1RAB9A

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 2/4885ALDH1A1 1504/4885HPGD 1873/4885

“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.