SCHEMBL17828183

SCHEMBL17828183

Cc1ccccc1CCN1CCC(C)CC1

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.71
HRH3 Q9Y5N1 1/20 0.54
SIGMAR1 Q99720 6/20 0.53
CHRNA7 P36544 1/20 0.50
KCNH2 Q12809 2/20 0.45
KDM1A O60341 1/20 0.44

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
SCHEMBL12013922 0.83 ACHE (1.00) ACHEHRH3
SCHEMBL11865007 0.83 ACHE (0.49) ACHEHRH3SIGMAR1KCNH2
SCHEMBL9254022 0.82 HRH3 (0.62) HRH3SIGMAR1KCNH2
SCHEMBL17117585 0.82 KCNH2 (0.70) ACHEHRH3SIGMAR1KCNH2
SCHEMBL791561 0.81 HRH3 (0.61) HRH3SIGMAR1CHRNA7KCNH2
SCHEMBL17828187 0.80 SIGMAR1 (0.77) HRH3SIGMAR1KCNH2
SCHEMBL12226961 0.78 CYP2A13 (0.70) SIGMAR1KCNH2
SCHEMBL152736 0.77 ACHE (1.00) ACHEHRH3SIGMAR1KCNH2
SCHEMBL15084359 0.77 ACHE (0.81) ACHESIGMAR1
Hydrochloric Acid SCHEMBL16934720 0.74 ACHE (0.43) ACHESIGMAR1KCNH2

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 ACHE 1829/4885HRH3 232/4885SIGMAR1 427/4885

“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.