SCHEMBL17820073

SCHEMBL17820073

COCCNCc1cccc(C(=O)N(C)OC)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 3/20 0.38
CD274 Q9NZQ7 3/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
BRD4 O60885 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ADORA2A P29274 1/20 0.35
USP2 O75604 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
APEX1 P27695 1/20 0.34
CASP7 P55210 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
GLA P06280 1/20 0.34
HRH3 Q9Y5N1 2/20 0.34
HDAC1 Q13547 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL17827867 0.78 CYP1A2 (0.40) BRD4CYP1A2
SCHEMBL17819497 0.78 TRPM8 (0.37) BRD4NPSR1ADORA2ACYP1A2
SCHEMBL28402819 0.77 TRPM8 (0.36) BRD4NPSR1ADORA2ACYP1A2
SCHEMBL17819762 0.77 TRPM8 (0.36) BRD4CYP1A2
SCHEMBL8374791 0.76 KDM4E (0.45) ALDH1A1TP53CYP1A2CYP3A4ALOX15
SCHEMBL17820658 0.76 KDM4E (0.36) ALDH1A1HPGDBRD4HDAC1KDM4E
SCHEMBL12453250 0.74 MRGPRX4 (0.49) BRD4NPSR1ADORA2ATP53CYP1A2
SCHEMBL17820475 0.74 ALDH1A1 (0.38) ALDH1A1BRD4NPSR1CYP1A2
SCHEMBL12453820 0.73 MRGPRX4 (0.48) BRD4NPSR1ADORA2ATP53CYP1A2
SCHEMBL17820224 0.72 CYP1A2 (0.36) BRD4CYP1A2CYP3A4

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 8 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
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
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 PDCD1 4209/4885CD274 4355/4885ALDH1A1 2519/4885

“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.