SCHEMBL19795849

SCHEMBL19795849

COc1ccc([C@H]2O[C@@H](c3ccc(C)cc3)N3C2C(=O)OC[C@@H]3c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.41
LMNA P02545 3/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CA1 P00915 1/20 0.37
CYP19A1 P11511 3/20 0.37
ADCY2 Q08462 1/20 0.36
ALDH1A1 P00352 3/20 0.35
MAOB P27338 3/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 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
SCHEMBL18011887 0.96 MAPK1 (0.44) MAPK1LMNAMAPTSMN1; SMN2MEN1
SCHEMBL19795853 0.88 MDM2 (0.38) LMNAMEN1KMT2A
SCHEMBL19795858 0.88 LMNA (0.34) LMNAMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL19795842 0.85 ALDH1A1 (0.34) LMNASMN1; SMN2MEN1KMT2ACYP19A1
SCHEMBL19795855 0.84 LMNA (0.35) LMNAMAPTMEN1KMT2A
SCHEMBL18012011 0.83 CYP19A1 (0.43) LMNAMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL19795850 0.82 CYP19A1 (0.40) LMNAMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL18012015 0.82 STING1 (0.35) MAPK1LMNAMAPTSMN1; SMN2MEN1
SCHEMBL18011890 0.82 MDM2 (0.38) MEN1KMT2A
SCHEMBL737972 0.81 TP53 (0.41) LMNASMN1; SMN2MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180022697-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS AND THERAPEUTIC METHODS USING THE SAME UNIV MICHIGAN REGENTS (US) 2018-01-25 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 (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-20180022697-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS AND THERAPEUTIC METHODS USING THE SAME GBA1, GBA2, GAA MAPK1 4023/4885LMNA 1219/4885MAPT 1916/4885

“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.