SCHEMBL4936760

SCHEMBL4936760

CC(C)(C)C(=O)CNC(=O)c1nn(-c2ccc(F)cc2)c2c1C1CCC2C1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.56
CNR1 P21554 2/20 0.56
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
TP53 P04637 1/20 0.37
RCE1 Q9Y256 1/20 0.36
THRB P10828 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL4933699 0.90 CNR2 (0.46) CNR2CNR1GAALMNA
SCHEMBL4934065 0.90 CNR2 (0.46) CNR2CNR1
SCHEMBL4925560 0.88 CNR1 (0.45) CNR2CNR1MEN1KMT2ATP53
SCHEMBL4934001 0.88 CNR2 (0.75) CNR2CNR1
SCHEMBL4936705 0.88 CNR2 (0.75) CNR2CNR1
SCHEMBL4934270 0.88 CNR2 (0.75) CNR2CNR1
SCHEMBL4935557 0.87 CNR2 (0.57) CNR2CNR1
SCHEMBL4936675 0.86 CNR2 (0.44) CNR2CNR1KMT2ALMNA
SCHEMBL1432263 0.85 CNR2 (0.74) CNR2CNR1MEN1KMT2AGAA
SCHEMBL4934259 0.82 CNR1 (0.61) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200501-A1 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION GLENMARK PHARMACEUTICALS S.A. (CH) 2008-08-21 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-20080200501-A1 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION CNR2, CNR1, OPRL1 CNR2 1/4885CNR1 2/4885MEN1 4398/4885

“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.