SCHEMBL30409305

SCHEMBL30409305

CC(C)n1nc(C(F)(F)F)cc1[C@@H]1CCC(=O)C1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP3K12 Q12852 12/20 0.36
DLK1 P80370 2/20 0.36
PLAT P00750 1/20 0.35
KCNN4 O15554 1/20 0.34
CRACR2A Q9BSW2 3/20 0.33
GRIN1 Q05586 2/20 0.33
GRIN2A Q12879 2/20 0.33

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
SCHEMBL25225550 1.00 MAP3K12 (0.36) MAP3K12DLK1PLATKCNN4CRACR2A
SCHEMBL25227346 0.92 MAP3K12 (0.35) MAP3K12DLK1PLATKCNN4CRACR2A
SCHEMBL25270744 0.92 MAP3K12 (0.35) MAP3K12DLK1PLATKCNN4CRACR2A
SCHEMBL25270745 0.92 MAP3K12 (0.35) MAP3K12DLK1PLATKCNN4CRACR2A
SCHEMBL25230154 0.92 MAP3K12 (0.40) MAP3K12DLK1PLATCRACR2AGRIN1
SCHEMBL6887363 0.83 MAP3K12 (0.44) MAP3K12DLK1CRACR2A
SCHEMBL25226539 0.82 IDH1 (0.42) MAP3K12
SCHEMBL25277885 0.82 IDH1 (0.42) MAP3K12
SCHEMBL31575545 0.82 MAP3K12 (0.48) MAP3K12DLK1
SCHEMBL25272259 0.82 IDH1 (0.42) MAP3K12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240398781-A1 SPIROCYCLIC CYCLIC MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION CONVELO THERAPEUTICS, INC. 2024-12-05 US disclosed
EP-4436975-A1 SPIROCYCLIC CYCLIC MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION Genentech, Inc. (US) 2024-10-02 EP disclosed
CN-118696050-A Spirocyclic cyclic modulators of cholesterol biosynthesis and their use for promoting remyelination 基因泰克公司 2024-09-24 CN disclosed
WO-2023097233-A1 SPIROCYCLIC CYCLIC MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION GENENTECH, INC. (US) 2023-06-01 WO 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-20240398781-A1 SPIROCYCLIC CYCLIC MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION MAG, PMP22, NR1H2 MAP3K12 2154/4885DLK1 792/4885PLAT 4282/4885

“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.