SCHEMBL5064597

SCHEMBL5064597

COc1cccc(C2=Nc3cc(C(=O)NC4CCC(F)(F)CC4)ccc3Sc3ccccc32)n1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 7/20 0.49
CNR1 P21554 7/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
CNR2 P34972 2/20 0.44
LMNA P02545 3/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.43
MAPT P10636 1/20 0.42

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
SCHEMBL13808201 0.90 TP53 (0.51) TP53CNR1MEN1KMT2ASMN1; SMN2
SCHEMBL13808150 0.85 CNR1 (0.63) TP53CNR1MEN1KMT2ASMN1; SMN2
SCHEMBL5058763 0.82 CNR1 (0.59) TP53CNR1SMN1; SMN2CNR2LMNA
SCHEMBL5064623 0.81 CNR1 (0.51) TP53CNR1MEN1KMT2ASMN1; SMN2
SCHEMBL5064860 0.81 CNR1 (0.57) TP53CNR1MEN1KMT2ASMN1; SMN2
SCHEMBL5057728 0.80 CNR1 (0.64) TP53CNR1MEN1KMT2ASMN1; SMN2
SCHEMBL5057287 0.80 CNR1 (0.62) TP53CNR1MEN1KMT2ASMN1; SMN2
SCHEMBL5058685 0.80 TP53 (0.51) TP53CNR1MEN1KMT2ASMN1; SMN2
SCHEMBL13807963 0.80 CNR1 (0.56) TP53CNR1SMN1; SMN2CNR2LMNA
SCHEMBL5057712 0.79 TP53 (0.50) TP53CNR1MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009075691-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2009-06-18 WO disclosed
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-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2008-04-17 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-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE CNR1, CNR2, FAAH TP53 4870/4885CNR1 1/4885MEN1 4178/4885

“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.