SCHEMBL14900360

SCHEMBL14900360

CCCCN(C)CCCCl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
TDP1 Q9NUW8 1/20 0.53
MAPT P10636 1/20 0.50
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
HTT P42858 1/20 0.48
HBB P68871 1/20 0.48
S1PR2 O95136 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
S1PR5 Q9H228 1/20 0.39
KDM4C Q9H3R0 5/20 0.38
KDM5A P29375 4/20 0.38
DNM1 Q05193 3/20 0.38
PHF8 Q9UPP1 1/20 0.36
KDM4A O75164 1/20 0.36
CHRM2 P08172 1/20 0.36
GGPS1 O95749 1/20 0.35
FDPS P14324 1/20 0.35

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
SCHEMBL7265266 0.90 TSHR (0.57) TSHRTDP1MAPTALDH1A1LMNA
SCHEMBL13137722 0.89
SCHEMBL11472367 0.88 MAPT (0.62) TSHRTDP1MAPTALDH1A1LMNA
Hydrochloric Acid SCHEMBL1919723 0.86 TSHR (0.68) TSHRTDP1MAPTALDH1A1LMNA
Hydrochloric Acid SCHEMBL11465486 0.85 TSHR (0.65) TSHRTDP1MAPTALDH1A1LMNA
SCHEMBL78617 0.85 DNM1 (0.47) TSHRLMNAS1PR2S1PR1S1PR3
SCHEMBL17309881 0.82
Bromide SCHEMBL8466957 0.82 TSHR (0.62) TSHRTDP1MAPTALDH1A1LMNA
Hydrochloric Acid SCHEMBL1997515 0.82 DNM1 (0.50) TSHRLMNATP53HTTHBB
Bromide SCHEMBL1993994 0.82 DNM1 (0.50) TSHRLMNAS1PR2S1PR1S1PR3

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-9174958-B2 Process for the preparation of dronedarone SANOFI (FR) 2015-11-03 US disclosed
US-20130109868-A1 Process for the Preparation of Dronedarone SANOFI (FR) 2013-05-02 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-20130109868-A1 Process for the Preparation of Dronedarone CYP2D6, CYP2B6, CYP2F1 TSHR 4058/4885TDP1 2601/4885MAPT 4369/4885

“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.