SCHEMBL17819481

SCHEMBL17819481

CC(C)(C)OC(=O)N1CCCC1C(=O)Nc1ccc2c(c1)Cc1cccc(-c3cc(N4CCOCC4)cc(=O)[nH]3)c1O2

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.43
NPSR1 Q6W5P4 2/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PIK3C3 Q8NEB9 2/20 0.40
ATM Q13315 2/20 0.40
USP30 Q70CQ3 1/20 0.39
JAK2 O60674 2/20 0.39
JAK3 P52333 1/20 0.39
SIRT2 Q8IXJ6 2/20 0.38
RAB9A P51151 1/20 0.36
EPHX2 P34913 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
UCHL1 P09936 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
SCHEMBL17819483 1.00 NPC1 (0.43) NPC1NPSR1LMNAMEN1KMT2A
SCHEMBL17906851 0.90 PIK3C3 (0.40) NPSR1LMNAKMT2APIK3C3ATM
SCHEMBL17820218 0.84 PIK3C3 (0.40) NPC1PIK3C3ATMUSP30RAB9A
SCHEMBL17828146 0.84 GAA (0.41) PIK3C3ATMUSP30
SCHEMBL17828149 0.84 PIK3C3 (0.42) NPC1PIK3C3ATMUSP30RAB9A
SCHEMBL17828158 0.84 PIK3C3 (0.40) LMNAMEN1KMT2APIK3C3ATM
SCHEMBL17828148 0.83 PIK3C3 (0.42) PIK3C3ATMUSP30
SCHEMBL17828147 0.83 USP30 (0.42) NPC1PIK3C3ATMUSP30RAB9A
SCHEMBL17819903 0.81 ATM (0.45) NPC1NPSR1LMNAMEN1KMT2A
SCHEMBL17819901 0.81 ATM (0.45) NPC1NPSR1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3042900-B1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORP (JP) 2020-09-23 EP disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 US disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 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-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF PRMT7, RBBP7, RER1 NPC1 3926/4885NPSR1 1133/4885LMNA 2540/4885

“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.