SCHEMBL4249813

SCHEMBL4249813

O=C(OCC1C2CCC1CN(Cc1ccccc1)C2)N(Cc1ccc(C(F)(F)F)cc1)c1cccc(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.47
CHRM2 P08172 5/20 0.46
CHRM1 P11229 5/20 0.46
CHRM3 P20309 5/20 0.46
KCNH2 Q12809 2/20 0.42
UBE2M P61081 2/20 0.42
DCUN1D1 Q96GG9 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
S1PR5 Q9H228 3/20 0.40
S1PR1 P21453 2/20 0.40
GRK5 P34947 1/20 0.40
CDK8 P49336 1/20 0.40
BCHE P06276 2/20 0.40
BACE1 P56817 2/20 0.40
SIGMAR1 Q99720 3/20 0.40
PDGFRA P16234 1/20 0.40
HIF1A Q16665 1/20 0.39
EPAS1 Q99814 1/20 0.39
OPRM1 P35372 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
SCHEMBL4250571 0.93 CHRM2 (0.52) ACHECHRM2CHRM1CHRM3KCNH2
SCHEMBL4245844 0.93 ACHE (0.48) ACHECHRM2CHRM1CHRM3KCNH2
SCHEMBL4244214 0.92 KCNH2 (0.45) ACHECHRM2CHRM1CHRM3KCNH2
SCHEMBL4246952 0.91 CHRM2 (0.48) ACHECHRM2CHRM1CHRM3KCNH2
SCHEMBL4244250 0.89 PTGIR (0.50) ACHEMEN1KMT2APTGER4PTGER3
SCHEMBL4248307 0.89 CHRM2 (0.52) ACHECHRM2CHRM1CHRM3KCNH2
SCHEMBL4246887 0.88 CHRM1 (0.49) ACHECHRM2CHRM1CHRM3KCNH2
SCHEMBL4245563 0.84 ACHE (0.49) ACHECHRM2CHRM1CHRM3KCNH2
SCHEMBL4240764 0.84 CHRM1 (0.46) ACHECHRM2CHRM1CHRM3KCNH2
SCHEMBL4248347 0.84 CHRM2 (0.52) ACHECHRM2CHRM1CHRM3BCHE

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-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 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-20090012116-A1 Muscarinic Receptor Antagonists CHRM3, CHRM2, CHRM5 ACHE 108/4885CHRM2 2/4885CHRM1 5/4885

“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.