SCHEMBL1023344

SCHEMBL1023344

CN1CCC(OC(=O)OC2CCN(C)CC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 4/20 0.53
SCN2A Q99250 4/20 0.53
SCN3A Q9NY46 4/20 0.53
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
CHRM3 P20309 3/20 0.51
CHRM4 P08173 1/20 0.51
CHRM5 P08912 1/20 0.51
CHRM1 P11229 1/20 0.51
ALDH1A1 P00352 2/20 0.46
ATM Q13315 1/20 0.46
RAB9A P51151 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
Hydrochloric Acid SCHEMBL28532026 0.98 KMT2A (0.56) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL1818116 0.94 SCN1A (0.49) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL18687104 0.91 SCN1A (0.50) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL1818115 0.87 SCN1A (0.47) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL23199841 0.86 CHRM4 (0.54) SCN1ASCN2ASCN3AKMT2AMEN1
Hydrochloric Acid SCHEMBL23199820 0.85 SMN1; SMN2 (0.53) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL9330353 0.84 SCN1A (0.49) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL18195619 0.84 CHRM3 (0.45) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL12879857 0.84 SCN1A (0.45) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL14476943 0.84 SCN1A (0.45) SCN1ASCN2ASCN3AKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210253626-A1 PRODRUGS OF FULVESTRANT KI PHARMACEUTICALS, LLC 2021-08-19 US disclosed
EP-3801553-A2 PRODRUGS OF FULVESTRANT Kashiv Biosciences, LLC (US) 2021-04-14 EP disclosed
CN-110156763-B Posaconazole derivative, pharmaceutical composition and application thereof 北京国鸿生物医药科技有限公司 2021-03-23 CN disclosed
EP-1602362-B1 DRUG COMPOSITION HAVING ACTIVE INGREDIENT ADHERED AT HIGH CONCENTRATION TO SPHERICAL CORE TAKEDA PHARMACEUTICAL (JP) 2016-09-28 EP disclosed
EP-2275088-B1 Method for producing granules TAKEDA PHARMACEUTICAL (JP) 2015-09-02 EP disclosed
EP-2275088-A2 Method for producing granules Takeda Pharmaceutical Company Limited (JP) 2011-01-19 EP disclosed
EP-1852100-A1 METHOD FOR PRODUCING GRANULES Takeda Pharmaceutical Company Limited (JP) 2007-11-07 EP 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-20210253626-A1 PRODRUGS OF FULVESTRANT CYP19A1, PGR, CYP21A2 SCN1A 4596/4885SCN2A 3668/4885SCN3A 4573/4885

“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.