SCHEMBL17820564

SCHEMBL17820564

Cc1cccc(C(=O)C2CCCN(C(=O)OC(C)(C)C)C2)n1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 2/20 0.48
MAPT P10636 1/20 0.48
HSD11B1 P28845 1/20 0.45
USP30 Q70CQ3 1/20 0.45
GRM5 P41594 1/20 0.44
CCNA2 P20248 1/20 0.44
CDK2 P24941 1/20 0.44
CDK5 Q00535 1/20 0.44
CDK5R1 Q15078 1/20 0.44
PLA2G1B P04054 1/20 0.44
ATG4B Q9Y4P1 1/20 0.44
HPGD P15428 1/20 0.43
PARP1 P09874 1/20 0.43
HPGDS O60760 1/20 0.42
STS P08842 1/20 0.42
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL17827894 0.93 STS (0.48) KMT2AHSD11B1USP30GRM5CCNA2
SCHEMBL3324042 0.83 PLA2G1B (0.60) KMT2AALDH1A1MEN1MAPTHSD11B1
SCHEMBL3324037 0.83 PLA2G1B (0.60) KMT2AALDH1A1MEN1MAPTHSD11B1
SCHEMBL25405836 0.81 ALDH1A1 (0.49) KMT2AALDH1A1MEN1MAPTHSD11B1
SCHEMBL31399813 0.81 ALDH1A1 (0.49) KMT2AALDH1A1MEN1MAPTHSD11B1
SCHEMBL31043023 0.80 MEN1 (0.48) KMT2AALDH1A1MEN1MAPTHSD11B1
SCHEMBL3325048 0.79 ALDH1A1 (0.58) KMT2AALDH1A1MEN1MAPTUSP30
SCHEMBL969043 0.79 ALDH1A1 (0.58) KMT2AALDH1A1MEN1MAPTUSP30
SCHEMBL969044 0.79 ALDH1A1 (0.58) KMT2AALDH1A1MEN1MAPTUSP30
SCHEMBL2328924 0.79 USP30 (0.53) KMT2AALDH1A1MEN1MAPTUSP30

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 KMT2A 1128/4885ALDH1A1 2519/4885MEN1 772/4885

“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.