SCHEMBL2362048

SCHEMBL2362048

O=C(O)N(c1ccc(-c2ccccc2)cc1)C1CC1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MITF O75030 1/20 0.45
ALDH1A1 P00352 1/20 0.45
PAX8 Q06710 1/20 0.45
ENPP2 Q13822 1/20 0.45
CHRM4 P08173 1/20 0.43
CHRM2 P08172 8/20 0.42
CHRM3 P20309 8/20 0.42
TRPM8 Q7Z2W7 1/20 0.42
OPRM1 P35372 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
FASN P49327 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
SCHEMBL5492701 0.91 ALDH1A1 (0.56) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL28891615 0.88 MEN1 (0.54) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2566187 0.85 MCHR1 (0.53) CHRM2CHRM3OPRM1
SCHEMBL2712659 0.82 MEN1 (0.62) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL20477164 0.82 S1PR5 (0.53)
SCHEMBL12614550 0.82 GPR119 (0.41) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL11407980 0.81 MEN1 (0.65) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL28017518 0.81 CHRM2 (0.50) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL1526062 0.80 FFAR4 (0.49) ALDH1A1
SCHEMBL12614459 0.79 CHRM3 (0.52) NPC1RAB9AMEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20150210681-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2015-07-30 US disclosed
EP-2361242-A1 OXIDASE INHIBITORS AND THEIR USE Oryzon Genomics, S.A. (ES) 2011-08-31 EP disclosed
WO-2010043721-A1 OXIDASE INHIBITORS AND THEIR USE ORYZON GENOMICS, S.A. (ES) 2010-04-22 WO 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 (3 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-20150210681-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, GAA NPC1 100/4885RAB9A 699/4885MEN1 1532/4885
US-20180065957-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, GAA NPC1 100/4885RAB9A 699/4885MEN1 1532/4885
US-11008316-B2 Glucosylceramide synthase inhibitors GBA1, GBA2, GAA NPC1 79/4885RAB9A 641/4885MEN1 1628/4885

“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.