SCHEMBL17511540

SCHEMBL17511540

CC(=O)Nc1ccccc1N1CCN([C@H]2Cc3cccc(I)c3C[C@H]2O)CC1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 8/20 0.55
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
POLB P06746 2/20 0.41
MAPK1 P28482 1/20 0.41
PIM1 P11309 1/20 0.41
PIM3 Q86V86 1/20 0.41

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
SCHEMBL17491562 1.00 SLC18A3 (0.55) SLC18A3KDM4ELMNAGLAGAA
SCHEMBL17506075 1.00 SLC18A3 (0.55) SLC18A3KDM4ELMNAGLAGAA
SCHEMBL7536784 0.97 SLC18A3 (0.59) SLC18A3KDM4ELMNAGLAGAA
SCHEMBL7536782 0.97 SLC18A3 (0.59) SLC18A3KDM4ELMNAGLAGAA
SCHEMBL7536778 0.97 SLC18A3 (0.59) SLC18A3KDM4ELMNAGLAGAA
SCHEMBL17491563 0.88 SLC18A3 (0.59) SLC18A3
SCHEMBL18708687 0.88 SLC18A3 (0.56) SLC18A3KDM4ELMNAGLAGAA
SCHEMBL7537160 0.85 SLC18A3 (0.62) SLC18A3
SCHEMBL7537155 0.85 SLC18A3 (0.62) SLC18A3
SCHEMBL7537087 0.82 SLC18A3 (0.56) SLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9610369-B2 Compound suitable for detection of vesicular acetylcholine transporter HAMAMATSU PHOTONICS K.K. (JP) 2017-04-04 US disclosed
US-20160051711-A1 COMPOUND SUITABLE FOR DETECTION OF VESICULAR ACETYLCHOLINE TRANSPORTER NARD INSTITUTE, LTD. (JP) 2016-02-25 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-20160051711-A1 COMPOUND SUITABLE FOR DETECTION OF VESICULAR ACETYLCHOLINE TRANSPORTER SLC18A3, SLC18A2, CHAT SLC18A3 1/4885KDM4E 3576/4885LMNA 4041/4885

“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.