SCHEMBL4562577

SCHEMBL4562577

C[S+]([O-])c1ccc2c(c1)n(CC1CCCCC1)c(=O)n2C(=O)NCC(C)(C)CC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.36
CNR2 P34972 9/20 0.35
CNR1 P21554 7/20 0.35
PARG Q86W56 6/20 0.35
NPC1 O15118 1/20 0.34
ECE1 P42892 1/20 0.33
RORC P51449 1/20 0.31

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
SCHEMBL3918918 0.82 CNR2 (0.55) PLA2G2ACNR2CNR1PARGNPC1
SCHEMBL735903 0.80 CNR2 (0.48) CNR2CNR1
SCHEMBL3915272 0.72 CNR2 (0.44) CNR2CNR1
SCHEMBL3925596 0.69 CNR2 (0.44) CNR2CNR1
SCHEMBL4385172 0.68 CNR2 (0.59) PLA2G2ACNR2CNR1NPC1
SCHEMBL3916224 0.68 CNR2 (0.59) CNR2CNR1NPC1
SCHEMBL14261258 0.68 CNR2 (0.59) CNR2CNR1NPC1
SCHEMBL14260974 0.68 CNR2 (0.59) PLA2G2ACNR2CNR1NPC1
SCHEMBL736776 0.68 CNR2 (0.51) CNR2CNR1NPC1
SCHEMBL3925911 0.67 CNR2 (0.58) CNR2CNR1NPC1

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-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES PFIZER INC 2009-12-03 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-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES TRPV1, CNR1, CNR2 PLA2G2A 2857/4885CNR2 3/4885CNR1 2/4885

“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.