SCHEMBL17820215

SCHEMBL17820215

CC1(C)OB(c2cccc3c2Oc2cccc(NC(=O)O)c2C3)OC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
LIPE Q05469 7/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
LIPG Q9Y5X9 1/20 0.30

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
SCHEMBL17831354 0.86 AAK1 (0.35) NPC1RAB9ALIPELMNA
SCHEMBL17820895 0.80 CYP1A2 (0.34) NPC1RAB9AMEN1ALDH1A1KMT2A
SCHEMBL17819797 0.80 CYP1A2 (0.34) NPC1RAB9AMEN1ALDH1A1KMT2A
SCHEMBL17820806 0.77 MEN1 (0.40) NPC1RAB9AMEN1ALDH1A1LMNA
SCHEMBL17819981 0.75 CA1 (0.34) NPC1RAB9AMEN1ALDH1A1KMT2A
SCHEMBL20293692 0.74 LIPE (0.39) NPC1RAB9ALIPELIPG
SCHEMBL1058987 0.74 LIPE (0.48) NPC1RAB9ALIPEALDH1A1LIPG
SCHEMBL26119279 0.70 LIPE (0.39) LIPELIPG
SCHEMBL7378071 0.69 MAOA (0.47) NPC1RAB9AALDH1A1
SCHEMBL17827851 0.69 SIRT2 (0.38) LIPE

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-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
EP-3042900-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF Fujifilm Corporation (JP) 2016-07-13 EP 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 3926/4885RAB9A 757/4885LIPE 4779/4885

“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.