SCHEMBL2429562

SCHEMBL2429562

Cc1noc(NC(=O)N2CCC3(CC2)C[C@@H](c2cccc(C(F)(F)F)c2)CO3)c1C

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.44
LMNA P02545 2/20 0.42
RAF1 P04049 1/20 0.40
BRAF P15056 1/20 0.40
CCR2 P41597 1/20 0.39
TRPM8 Q7Z2W7 6/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
RECQL P46063 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA2B P29275 1/20 0.38
ADORA1 P30542 1/20 0.38
CHRM4 P08173 1/20 0.37
GRIN2B Q13224 1/20 0.37
FLT1 P17948 1/20 0.37
KDR P35968 1/20 0.37

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
SCHEMBL2425659 1.00 MGLL (0.44) MGLLLMNARAF1BRAFCCR2
SCHEMBL12295576 0.89 MGLL (0.42) MGLLTRPM8
SCHEMBL2345762 0.88 MGLL (0.50) MGLLLMNACCR2MEN1MAPT
SCHEMBL2428516 0.88 RAF1 (0.40) MGLLLMNARAF1BRAFTRPM8
SCHEMBL2428666 0.88 RAF1 (0.40) MGLLLMNARAF1BRAFTRPM8
SCHEMBL2420700 0.88 MGLL (0.60) MGLLTRPM8FLT1
SCHEMBL2431263 0.87 MGLL (0.41) MGLLTRPM8MEN1MAPTHTT
SCHEMBL2427040 0.85 MGLL (0.40) MGLLLMNARAF1BRAFMEN1
SCHEMBL2429550 0.85 MGLL (0.40) MGLLLMNARAF1BRAFMEN1
SCHEMBL2427358 0.85 MGLL (0.40) MGLLLMNARAF1BRAFMEN1

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-20110230493-A1 1-OXA-8-Azaspiro [4,5] Decabe-8-Carboxamide Compounds as FAAH Inhibitors PFIZER INC. 2011-09-22 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-20110230493-A1 1-OXA-8-Azaspiro [4,5] Decabe-8-Carboxamide Compounds as FAAH Inhibitors FAAH, FAAH2, FFAR1 MGLL 246/4885LMNA 3357/4885RAF1 2947/4885

“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.