SCHEMBL17819849

SCHEMBL17819849

CC(C)Nc1cncc(CO)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 3/20 0.40
▸ CYP2A6 P11509 1/20 0.38
▸ HTR7 P34969 3/20 0.36
▸ CYP11B1 P15538 2/20 0.36
▸ CYP11B2 P19099 2/20 0.36
▸ SCN10A Q9Y5Y9 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.33
▸ KDM5B Q9UGL1 1/20 0.33
▸ CSNK2A1 P68400 2/20 0.31
▸ AOC1 P19801 2/20 0.31
▸ AOC3 Q16853 2/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ CSNK2A2 P19784 1/20 0.31
▸ CSNK2B P67870 1/20 0.31
▸ TLR8 Q9NR97 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ DYRK1A Q13627 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
SCHEMBL17828144 0.83 GPR55 (0.38) FDPSHTR7TDP1CSNK2A1AOC1
SCHEMBL18477982 0.72 TDP1 (0.38) CYP2A6HTR7TDP1
SCHEMBL2728918 0.72 CYP2A6 (0.47) CYP2A6CYP11B1CYP11B2KDM4EDYRK1A
SCHEMBL3103283 0.72 TDP1 (0.48) HTR7TDP1
SCHEMBL1558215 0.71 CSF1R (0.41) TDP1KDM4E
SCHEMBL12368483 0.71 IDH1 (0.39) HTR7TDP1DYRK1A
SCHEMBL21100840 0.71 TDP1 (0.37) FDPSHTR7TDP1AOC1AOC3
SCHEMBL22607264 0.71 KCNH2 (0.39) HTR7TDP1AOC1AOC3PIM1
SCHEMBL5108969 0.71 CYP2A6 (0.41) CYP2A6CYP11B1CYP11B2KDM5BKDM4E
SCHEMBL7879502 0.71 TDP1 (0.37) FDPSHTR7TDP1AOC1AOC3

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 6 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-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
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 FDPS 4879/4885CYP2A6 2190/4885HTR7 425/4885

“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.

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