SCHEMBL19924236

SCHEMBL19924236

CC(C)(NC(=O)O)c1ccc(-c2ccc(OCCn3ccnn3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATP4A P20648 1/20 0.41
▸ ATP4B P51164 1/20 0.41
▸ ACACB O00763 1/20 0.41
▸ PIN1 Q13526 1/20 0.39
▸ TBXAS1 P24557 6/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ CASP3 P42574 1/20 0.37
▸ SENP8 Q96LD8 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ SENP6 Q9GZR1 1/20 0.37
▸ MCL1 Q07820 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ KCNA5 P22460 1/20 0.35
▸ CYP19A1 P11511 1/20 0.35
▸ MITF O75030 1/20 0.35
▸ TP53 P04637 1/20 0.35

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
SCHEMBL19924242 0.95 ATP4A (0.47) ATP4AATP4BACACBPIN1TBXAS1
SCHEMBL15579221 0.85 ATP4A (0.43) ATP4AATP4BPIN1TBXAS1NPC1
SCHEMBL19924190 0.85 JAK2 (0.47) ACACBPIN1TBXAS1NPC1LMNA
SCHEMBL15579192 0.82 HRH2 (0.41) ATP4AATP4BPIN1TBXAS1MAPT
SCHEMBL15579233 0.80 ATP4A (0.49) ATP4AATP4BPIN1TBXAS1LMNA
SCHEMBL29387708 0.79 NTMT1 (0.49) —
SCHEMBL15579223 0.78 ATP4A (0.33) ATP4AATP4BACACBKCNA5
SCHEMBL16933442 0.77 ATP4A (0.32) ATP4AATP4BACACBKCNA5
SCHEMBL15579177 0.77 ACACB (0.33) ATP4AATP4BACACBKCNA5
SCHEMBL15577932 0.76 ACACB (0.49) ACACBNPC1LMNAMAPTCASP3

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 ATP4A 1220/4885ATP4B 2070/4885ACACB 132/4885
US-11008316-B2 Glucosylceramide synthase inhibitors GBA1, GBA2, GAA ATP4A 1465/4885ATP4B 2238/4885ACACB 106/4885

“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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