SCHEMBL19090879

SCHEMBL19090879

CNCCCN1CCC(OCc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.86

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 19/20 0.86
PRMT6 Q96LA8 19/20 0.86
PRMT8 Q9NR22 3/20 0.60
TMEM97 Q5BJF2 1/20 0.60
SIGMAR1 Q99720 1/20 0.60
HRH3 Q9Y5N1 1/20 0.60
PRMT3 O60678 1/20 0.50
SLC6A5 Q9Y345 1/20 0.49

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
SCHEMBL20988126 0.88 CARM1 (0.71) CARM1PRMT6PRMT8TMEM97SIGMAR1
SCHEMBL19080588 0.87 CARM1 (0.70) CARM1PRMT6PRMT8TMEM97SIGMAR1
SCHEMBL12049739 0.81 CARM1 (0.70) CARM1PRMT6SIGMAR1SLC6A5
SCHEMBL7530604 0.79 CARM1 (0.61) CARM1PRMT6HRH3SLC6A5
SCHEMBL12041768 0.79 CARM1 (0.68) CARM1PRMT6PRMT8TMEM97SIGMAR1
SCHEMBL12041767 0.77 CARM1 (0.65) CARM1PRMT6PRMT8TMEM97SIGMAR1
SCHEMBL381729 0.76 CARM1 (0.64) CARM1PRMT6PRMT8TMEM97SIGMAR1
SCHEMBL22854624 0.76 CARM1 (1.00) CARM1PRMT6PRMT8TMEM97SIGMAR1
Lithium Ion SCHEMBL381730 0.75 CARM1 (0.63) CARM1PRMT6SLC6A5
SCHEMBL7529625 0.75 CARM1 (0.56) CARM1PRMT6HRH3SLC6A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10696707-B2 Polyene macrolide derivative SHIONOGI & CO., LTD. (JP) 2020-06-30 US disclosed
US-20190135847-A1 POLYENE MACROLIDE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2019-05-09 US disclosed
US-10246478-B2 Polyene macrolide derivative SHIONOGI & CO., LTD. (JP) 2019-04-02 US disclosed
US-20170190729-A1 POLYENE MACROLIDE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2017-07-06 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 (4 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-20170190729-A1 POLYENE MACROLIDE DERIVATIVE ERG28, RPL23, RPL10 CARM1 4486/4885PRMT6 4274/4885PRMT8 4169/4885
US-10246478-B2 Polyene macrolide derivative ERG28, RPL23, RPL10 CARM1 4486/4885PRMT6 4274/4885PRMT8 4169/4885
US-20190135847-A1 POLYENE MACROLIDE DERIVATIVE ERG28, RPL23, RPL10 CARM1 4486/4885PRMT6 4274/4885PRMT8 4169/4885
US-10696707-B2 Polyene macrolide derivative ERG28, RPL23, RPL10 CARM1 4486/4885PRMT6 4274/4885PRMT8 4169/4885

“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.