SCHEMBL19924190

SCHEMBL19924190

CC(C)(NC(=O)O)c1ccc(-c2ccc(OCCn3cccn3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 1/20 0.47
▸ PRKAB2 O43741 1/20 0.47
▸ PRKAG1 P54619 1/20 0.47
▸ PRKAA2 P54646 1/20 0.47
▸ PRKAA1 Q13131 1/20 0.47
▸ PRKAG3 Q9UGI9 1/20 0.47
▸ PRKAG2 Q9UGJ0 1/20 0.47
▸ PRKAB1 Q9Y478 1/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ THRB P10828 1/20 0.46
▸ ACACB O00763 1/20 0.43
▸ BPTF Q12830 1/20 0.41
▸ CECR2 Q9BXF3 1/20 0.41
▸ BRD9 Q9H8M2 1/20 0.41
▸ LMNA P02545 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ MITF O75030 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ RAB9A P51151 1/20 0.40

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
SCHEMBL15579259 0.85 PRKAB2 (0.49) JAK2PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL19924236 0.85 ATP4A (0.41) MCL1ACACBLMNANPC1SMN1; SMN2
SCHEMBL15579124 0.83 THRB (0.46) JAK2PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL19924242 0.80 ATP4A (0.47) ACACBLMNANPC1SMN1; SMN2MAPT
SCHEMBL29399378 0.79 NTMT1 (0.49) —
SCHEMBL15579263 0.78 JAK2 (0.41) JAK2PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL16933505 0.77 JAK2 (0.41) JAK2PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL15577932 0.76 ACACB (0.49) ACACBLMNANPC1SMN1; SMN2RAB9A
SCHEMBL15578173 0.75 KDM4E (0.52) ACACBLMNANPC1SMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL6954959 0.74 TBXAS1 (0.60) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3

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-4098654-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS Genzyme Corporation (US) 2022-12-07 — — EP disclosed
EP-2895484-B1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORP (US) 2022-02-23 — — EP disclosed
US-11008316-B2 Glucosylceramide synthase inhibitors GENZYME CORPORATION (US) 2021-05-18 — — US disclosed
US-20180065957-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2018-03-08 — — 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-20180065957-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, GAA JAK2 3509/4885PRKAB2 3161/4885PRKAG1 1844/4885
US-11008316-B2 Glucosylceramide synthase inhibitors GBA1, GBA2, GAA JAK2 3677/4885PRKAB2 3315/4885PRKAG1 1985/4885

“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.

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