SCHEMBL10022757

SCHEMBL10022757

CC(C)C(OO)N1C(=O)CCC1=O

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL406639 0.77 CHRM2 (0.34) SLC1A2CHRM2CHRM4CHRM5CHRM1
SCHEMBL10022762 0.74 MGLL (0.33) ALDH1A1
SCHEMBL10022759 0.70 MME (0.33)
SCHEMBL18073624 0.69 CHRM2 (0.37) SLC1A2CHRM2CHRM4CHRM5CHRM1
SCHEMBL1536266 0.69 CHRM2 (0.37) SLC1A2CHRM2CHRM4CHRM5CHRM1
SCHEMBL19286980 0.69 CHRM2 (0.37) SLC1A2CHRM2CHRM4CHRM5CHRM1
SCHEMBL1698550 0.68 SMN1; SMN2 (0.41) SLC1A2CHRM2CHRM4CHRM5CHRM1
SCHEMBL8024903 0.67 CHRM2 (0.36) SLC1A2CHRM2CHRM4CHRM5CHRM1
SCHEMBL10644061 0.66 CHRM2 (0.38) SLC1A2CHRM2CHRM4CHRM5CHRM1
SCHEMBL14802499 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9513284-B2 Pyrenyloxysulfonic acid fluorescent agents Life Technologies Corporation (US) 2016-12-06 US disclosed
US-20140193926-A1 PYRENYLOXYSULFONIC ACID FLUORESCENT AGENTS Life Technologies Corporation (US) 2014-07-10 US disclosed
US-8476461-B2 Dipyrromethene-boron hydrophilic fluorescent compounds CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2013-07-02 US disclosed
US-8268886-B2 Pyrenyloxysulfonic acid fluorescent agents Life Technologies Corporation (US) 2012-09-18 US disclosed
US-20120045848-A1 PYRENYLOXYSULFONIC ACID FLUORESCENT AGENTS Life Technologies Corporation (US) 2012-02-23 US disclosed
US-20120009615-A1 DIPYRROMETHENE-BORON HYDROPHILIC FLUORESCENT COMPOUNDS UNIVERSITE DE STRASBOURG (50% PART INTEREST) (FR) 2012-01-12 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 (2 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-20120045848-A1 PYRENYLOXYSULFONIC ACID FLUORESCENT AGENTS NOP56, ANXA5, ANXA6 SLC1A2 4215/4885CHRM2 2686/4885CHRM4 1670/4885
US-20120009615-A1 DIPYRROMETHENE-BORON HYDROPHILIC FLUORESCENT COMPOUNDS LDHB, AHR, BCR SLC1A2 1316/4885CHRM2 2731/4885CHRM4 3578/4885

“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.