SCHEMBL9174304

SCHEMBL9174304

CC(C)CN(CC(C)C)C(C(C)C)C(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA9 Q16790 3/20 0.32
CYP1A2 P05177 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL2478796 0.72 CA12 (0.35) CA12CA1CA2CA9CYP1A2
SCHEMBL21141394 0.71 PIK3CD (0.33) CA12CA1CA2CA9CYP1A2
SCHEMBL11213322 0.69 ALDH1A1 (0.35)
SCHEMBL7056685 0.69 TSHR (0.44) CA12CA1CA2CA9
SCHEMBL21141114 0.69
SCHEMBL20119102 0.67 PIK3CD (0.31)
SCHEMBL3903707 0.67 CA12 (0.38) CA12CA1CA2CA9CYP1A2
SCHEMBL3461429 0.67 MAPK1 (0.35) CA12CA1CA2CA9CYP1A2
SCHEMBL19333307 0.67 CYP1A2 (0.38) CA12CA1CA2CA9CYP1A2
SCHEMBL7931272 0.67 CA12 (0.36) CA12CA1CA2CA9CYP1A2

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3010926-B1 ALKYLATION WITH AN ALKYL FLUOROALKYL SULFONATE NOVARTIS AG (CH) 2019-11-20 EP claimed
US-20160130280-A1 ALKYLATION WITH AN ALKYL FLUOROALKYL SULFONATE NOVARTIS AG (CH) 2016-05-12 US claimed
EP-3010926-A1 ALKYLATION WITH AN ALKYL FLUOROALKYL SULFONATE Novartis AG (CH) 2016-04-27 EP claimed
WO-2014203185-A1 ALKYLATION WITH AN ALKYL FLUOROALKYL SULFONATE NOVARTIS AG (CH) 2014-12-24 WO claimed
EP-0371528-B1 Triboelectrically processable powder coating DSM NV (NL) 1994-03-30 EP claimed
US-5124387-A Polyester binder, tertiary amine additive DSM N.V. (NL) 1992-06-23 US claimed
EP-0371528-A1 Triboelectrically processable powder coating DSM N.V. (NL) 1990-06-06 EP claimed
CN-109651396-B Alkylation of alkyl fluoroalkylsulfonates 诺华股份有限公司 2021-09-14 CN disclosed
CN-107735398-B Process for the synthesis of rapamycin derivatives 赛比亚斯药业股份公司 2020-07-31 CN disclosed
EP-3010926-B1 ALKYLATION WITH AN ALKYL FLUOROALKYL SULFONATE NOVARTIS AG (CH) 2019-11-20 EP disclosed
EP-3010926-B1 ALKYLATION WITH AN ALKYL FLUOROALKYL SULFONATE NOVARTIS AG (CH) 2019-11-20 EP disclosed
US-10308665-B2 Method for the synthesis of rapamycin derivatives SYNBIAS PHARMA AG (CH) 2019-06-04 US disclosed
EP-3313853-B1 METHOD FOR THE SYNTHESIS OF RAPAMYCIN DERIVATIVES SYNBIAS PHARMA AG (CH) 2019-05-08 EP disclosed
EP-0519999-B1 PREPARATION OF INDIUM ALKOXIDES SOLUBLE IN ORGANIC SOLVENTS EASTMAN KODAK CO (US) 1995-06-14 EP disclosed
EP-0371528-B1 Triboelectrically processable powder coating DSM NV (NL) 1994-03-30 EP disclosed
US-5237081-A Reacting indium halide with alcohol in presence of strong non-nucleophilic base, in anhydrous polar solvent, under inert gas EASTMAN KODAK COMPANY (US) 1993-08-17 US disclosed
EP-0519999-A1 PREPARATION OF INDIUM ALKOXIDES SOLUBLE IN ORGANIC SOLVENTS. EASTMAN KODAK CO (US) 1992-12-30 EP disclosed
US-5124387-A Polyester binder, tertiary amine additive DSM N.V. (NL) 1992-06-23 US disclosed
WO-1991013848-A1 PREPARATION OF INDIUM ALKOXIDES SOLUBLE IN ORGANIC SOLVENTS KODAK-PATHE (FR) 1991-09-19 WO disclosed
EP-0371528-A1 Triboelectrically processable powder coating DSM N.V. (NL) 1990-06-06 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 (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-10308665-B2 Method for the synthesis of rapamycin derivatives RICTOR, MTOR, MLST8 CA12 3899/4885CA1 1677/4885CA2 1467/4885
US-20160130280-A1 ALKYLATION WITH AN ALKYL FLUOROALKYL SULFONATE RICTOR, SULT2A1, POR CA12 3401/4885CA1 3430/4885CA2 1996/4885

“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.