SCHEMBL963166

SCHEMBL963166

CCOC(=O)Cn1/c(=N\C(=O)C23CC4CC(CC(C4)C2)C3)sc2ccccc21

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.70
CNR2 P34972 1/20 0.70
NPSR1 Q6W5P4 4/20 0.60
TP53 P04637 1/20 0.60
RECQL P46063 1/20 0.60
MAPT P10636 4/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
MITF O75030 1/20 0.58
KCNQ3 O43525 2/20 0.56
KCNQ2 O43526 2/20 0.56
F2 P00734 1/20 0.48
ALDH1A1 P00352 8/20 0.47
KDM4E B2RXH2 6/20 0.46
HPGD P15428 4/20 0.46
RXFP1 Q9HBX9 4/20 0.45
BLM P54132 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL963167 1.00 CNR1 (0.70) CNR1CNR2NPSR1TP53RECQL
SCHEMBL17007608 0.86 CNR1 (0.70) CNR1CNR2NPSR1TP53RECQL
SCHEMBL17007607 0.86 CNR1 (0.70) CNR1CNR2NPSR1TP53RECQL
SCHEMBL961830 0.83 CNR2 (0.94) CNR1CNR2NPSR1KCNQ3KCNQ2
SCHEMBL961828 0.83 CNR2 (0.94) CNR1CNR2NPSR1KCNQ3KCNQ2
SCHEMBL966963 0.82 CNR2 (0.74) CNR1CNR2NPSR1TP53MAPT
SCHEMBL966964 0.82 CNR2 (0.74) CNR1CNR2NPSR1TP53MAPT
SCHEMBL964313 0.81 CNR2 (0.78) CNR1CNR2NPSR1TP53RECQL
SCHEMBL964314 0.81 CNR2 (0.78) CNR1CNR2NPSR1TP53RECQL
SCHEMBL964561 0.79 KCNQ3 (0.69) CNR1CNR2NPSR1TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2024349-B1 COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF ABBVIE INC (US) 2017-08-02 EP disclosed
US-20150231141-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF ABBVIE INC (US) 2015-08-20 US disclosed
US-9006275-B2 Compounds as cannabinoid receptor ligands and uses thereof ABBVIE INC. (US) 2015-04-14 US disclosed
US-20110086855-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF ABBOTT LABORATORIES (US) 2011-04-14 US disclosed
US-7875639-B2 Compounds as cannabinoid receptor ligands and uses thereof ABBOTT LABORATORIES (US) 2011-01-25 US disclosed
US-20080064699-A1 Such as N-[3-(2-methoxyethyl)-1,3-thiazol-2(3H)-ylidene]adamantane-1-carboxamide; neuropathic, nociceptive and/or inflammatory pain; neuroprotection ABBVIE INC. 2008-03-13 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 (3 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-20150231141-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF CNR1, CNR2, OPRL1 CNR1 1/4885CNR2 2/4885NPSR1 8/4885
US-20110086855-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF CNR1, CNR2, OPRL1 CNR1 1/4885CNR2 2/4885NPSR1 8/4885
US-20080064699-A1 Such as N-[3-(2-methoxyethyl)-1,3-thiazol-2(3H)-ylidene]adamantane-1-carboxamide; neuropathic, nociceptive and/or inflammatory pain; neuroprotection OPRL1, OPRK1, OPRD1 CNR1 10/4885CNR2 5/4885NPSR1 183/4885

“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.