SCHEMBL19043296

SCHEMBL19043296

CCCCCCOc1ccc(OCCC=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.59
TP53 P04637 1/20 0.57
TSHR P16473 1/20 0.57
PLA2G4B P0C869 5/20 0.56
LTA4H P09960 3/20 0.53
RARB P10826 3/20 0.53
PLA2G4A P47712 1/20 0.50

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
SCHEMBL5258294 0.98 NR5A1 (0.56) NR5A1TP53TSHRPLA2G4BLTA4H
SCHEMBL19043228 0.94 LTA4H (0.52) NR5A1TP53TSHRPLA2G4BLTA4H
SCHEMBL7351935 0.93 NR5A1 (0.59) NR5A1TP53TSHRPLA2G4BLTA4H
SCHEMBL5252590 0.93 NR5A1 (0.59) NR5A1TP53TSHRPLA2G4BLTA4H
SCHEMBL7344078 0.91 NR5A1 (0.56) NR5A1TP53TSHRPLA2G4BLTA4H
SCHEMBL28084765 0.89 SMN1; SMN2 (0.58) PLA2G4A
SCHEMBL8815462 0.86 NR5A1 (0.53) NR5A1TP53TSHRPLA2G4B
SCHEMBL1667124 0.86 NR5A1 (0.53) NR5A1TP53TSHRPLA2G4B
SCHEMBL11319340 0.86 NR5A1 (0.53) NR5A1TP53TSHRPLA2G4B
SCHEMBL9265046 0.86 NR5A1 (0.53) NR5A1TP53TSHRPLA2G4B

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-20180093981-A1 2-Acylaminopropoanol-Type Glucosylceramide Synthase Inhibitors GENZYME CORPORATION 2018-04-05 US disclosed
US-9744153-B2 2-acylaminopropoanol-type glucosylceramide synthase inhibitors GENZYME CORPORATION (US) 2017-08-29 US disclosed
US-9745294-B2 2-acylaminopropoanol-type glucosylceramide synthase inhibitors GENZYME CORPORATION (US) 2017-08-29 US disclosed
EP-2320886-B1 GLUCOSYLCERAMIDE SYNTHASE INHIBITION FOR THE TREATMENT OF COLLAPSING GLOMERULOPATHY AND OTHER GLOMERULAR DISEASE GENZYME CORP (US) 2017-06-28 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 (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-20180093981-A1 2-Acylaminopropoanol-Type Glucosylceramide Synthase Inhibitors ASAH2, GBA1, GAA NR5A1 2377/4885TP53 4477/4885TSHR 2541/4885

“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.