SCHEMBL19253281

SCHEMBL19253281

CC[C@@H](C)C1CC[C@H]2[C@@H]3CC[C@@H]4C[C@@H](OS(=O)(=O)c5ccc(C)cc5)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 4/20 0.64
GRIN2B Q13224 4/20 0.64
ST6GAL1 P15907 2/20 0.57
VDR P11473 3/20 0.56
ABCC4 O15439 3/20 0.56
ABCC1 P33527 1/20 0.51
GPBAR1 Q8TDU6 1/20 0.50
USP2 O75604 1/20 0.49
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47

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
SCHEMBL19253282 1.00 GRIN1 (0.64) GRIN1GRIN2BST6GAL1VDRABCC4
SCHEMBL23865994 0.92 ST6GAL1 (0.59) GRIN1GRIN2BST6GAL1VDRABCC4
SCHEMBL11109512 0.89 ST6GAL1 (0.63) ST6GAL1VDRABCC4
SCHEMBL23628425 0.89 ST6GAL1 (0.63) ST6GAL1VDRABCC4
SCHEMBL3135366 0.89 ST6GAL1 (0.63) ST6GAL1VDRABCC4
SCHEMBL3135361 0.89 ST6GAL1 (0.63) ST6GAL1VDRABCC4
SCHEMBL19733273 0.85 GRIN1 (0.71) GRIN1GRIN2BST6GAL1VDRABCC4
SCHEMBL19253320 0.83 GRIN1 (0.67) GRIN1GRIN2BST6GAL1
SCHEMBL19733274 0.83 GRIN1 (0.84) GRIN1GRIN2BST6GAL1VDRABCC4
SCHEMBL19253322 0.83 GRIN1 (0.67) GRIN1GRIN2BST6GAL1

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
EP-3186267-B1 AMPHIPHILIC COMPOUNDS WITH NEUROPROTECTIVE PROPERTIES USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR V V I (CZ) 2019-10-02 EP disclosed
US-10017535-B2 Amphiphilic compounds with neuroprotective properties USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR, V.V.I. (CZ) 2018-07-10 US disclosed
EP-3260462-A1 AMPHIPHILIC COMPOUNDS WITH NEUROPROTECTIVE PROPERTIES Ustav Organicke Chemie A Biochemie Av Cr, V.v.i. (CZ) 2017-12-27 EP disclosed
US-20170240588-A1 AMPHIPHILIC COMPOUNDS WITH NEUROPROTECTIVE PROPERTIES USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR, V.V.I. (CZ) 2017-08-24 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-20170240588-A1 AMPHIPHILIC COMPOUNDS WITH NEUROPROTECTIVE PROPERTIES GAP43, GRIN2A, GRIN3A GRIN1 14/4885GRIN2B 8/4885ST6GAL1 1060/4885
US-10017535-B2 Amphiphilic compounds with neuroprotective properties GAP43, GRIN2A, GRIN3A GRIN1 14/4885GRIN2B 8/4885ST6GAL1 1060/4885

“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.