SCHEMBL14043602

SCHEMBL14043602

CC(C)NC(=O)N1c2ccc(C(=O)NCc3ccc(F)cc3)cc2N=C(c2ccc(F)cc2)c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.61
DRD2 P14416 3/20 0.43
DRD3 P35462 1/20 0.43
MAPT P10636 3/20 0.42
AKT1 P31749 1/20 0.41
PPARG P37231 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
USP1 O94782 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 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
SCHEMBL14513437 0.89 CNR1 (0.66) CNR1DRD2DRD3MAPTAKT1
SCHEMBL14043598 0.87 CNR1 (0.66) CNR1DRD2DRD3MAPTAKT1
SCHEMBL13807854 0.85 CNR1 (0.64) CNR1DRD2DRD3MAPTAKT1
SCHEMBL5064848 0.85 CNR1 (0.66) CNR1DRD2DRD3MAPTAKT1
SCHEMBL13807859 0.84 CNR1 (0.62) CNR1DRD2DRD3MAPTAKT1
SCHEMBL13807861 0.83 CNR1 (0.59) CNR1DRD2DRD3MAPTAKT1
SCHEMBL14205684 0.83 CNR1 (0.59) CNR1DRD2DRD3MAPTAKT1
SCHEMBL13807856 0.83 CNR1 (0.59) CNR1DRD2DRD3MAPTAKT1
SCHEMBL14205686 0.81 CNR1 (0.59) CNR1DRD2DRD3MAPTSMN1; SMN2
SCHEMBL14043682 0.80 CNR1 (0.57) CNR1DRD2DRD3MAPTAKT1

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
WO-2008118141-A2 USE OF CANNABINOID MODULATING COMPOUNDS IN COMBINATION WITH OTHER THERAPEUTIC COMPOUNDS FOR ADJUNCTIVE THERAPY ACADIA PHARMACEUTICALS INC. (US) 2008-10-02 WO disclosed
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2008-04-17 US disclosed
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2008-04-17 US disclosed
US-20070105819-A1 CB-1 modulating compounds and their use ACADIA PHARMACEUTICALS, INC. 2007-05-10 US disclosed
US-20070105819-A1 CB-1 modulating compounds and their use ACADIA PHARMACEUTICALS, INC. 2007-05-10 US disclosed
WO-2007047737-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2007-04-26 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 (2 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-20070105819-A1 CB-1 modulating compounds and their use CNR1, CNR2, FAAH CNR1 1/4885DRD2 751/4885DRD3 912/4885
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE CNR1, CNR2, FAAH CNR1 1/4885DRD2 751/4885DRD3 912/4885

“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.