SCHEMBL17828165

SCHEMBL17828165

Cc1ccc(CN2CCC(C)CC2)cn1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.60
ACHE P22303 5/20 0.56
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 1/20 0.46
LTA4H P09960 1/20 0.45
TLR9 Q9NR96 1/20 0.44
TLR8 Q9NR97 1/20 0.44
TLR7 Q9NYK1 1/20 0.44
HTR7 P34969 2/20 0.44
PARP1 P09874 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
SCHEMBL18291674 0.86 RAB9A (0.54) HRH3ACHEALDH1A1KMT2ALTA4H
SCHEMBL24681792 0.83 MGAT2 (0.44) HRH3ACHEKMT2ATLR9TLR8
SCHEMBL18291381 0.83 PDE1B (0.47) HRH3KMT2ALTA4HTLR9TLR8
SCHEMBL18291574 0.83 PARP1 (0.44) HRH3ALDH1A1KMT2ATLR9TLR8
SCHEMBL20038328 0.83 HRH3 (0.48) HRH3ACHEKMT2ALTA4HTLR9
SCHEMBL4554100 0.83 CHRNB2 (0.56) HRH3ALDH1A1
SCHEMBL12049097 0.83 CHRNB2 (0.51) HRH3ALDH1A1KMT2A
SCHEMBL2231495 0.83 HRH3 (0.58) HRH3ACHEALDH1A1KMT2ALTA4H
SCHEMBL4592039 0.83 HRH3 (0.63) HRH3ACHEALDH1A1KMT2A
SCHEMBL2231491 0.83 HRH3 (0.58) HRH3ACHEALDH1A1KMT2ALTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 HRH3 232/4885ACHE 1829/4885ALDH1A1 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.