SCHEMBL437855

SCHEMBL437855

CCCCc1cc2cc(CC(N)=O)ccc2o1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.43
F10 P00742 1/20 0.43
ALOX15 P16050 1/20 0.41
S1PR1 P21453 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
TLR8 Q9NR97 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
ALOX5 P09917 1/20 0.39
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL436265 0.82 S1PR1 (0.41) F2F10ALOX15S1PR1LMNA
SCHEMBL5225410 0.81 CA12 (0.47) F2F10ALOX15S1PR1TLR8
SCHEMBL7979172 0.79 GAA (0.51) F2F10LMNATP53ALDH1A1
SCHEMBL433953 0.78 STS (0.43) F2F10ALOX15S1PR1LMNA
SCHEMBL12370192 0.76 TLR8 (0.44) F2F10ALOX15TLR8TAS1R3
SCHEMBL12117962 0.76 MAPT (0.46) F2F10ALOX15LMNATP53
SCHEMBL3244824 0.76 TBXAS1 (0.51) F2F10ALOX15TP53
SCHEMBL284155 0.75 TLR8 (0.50) F2F10ALOX15TLR8MEN1
SCHEMBL18067895 0.75 S1PR1 (0.44) F2F10S1PR1TLR8HPGD
SCHEMBL2330441 0.75 ALOX15 (0.58) F2F10ALOX15LMNATLR8

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-8816103-B2 Process for the preparation of dronedarone SANOFI (FR) 2014-08-26 US disclosed
EP-2595978-A1 NOVEL PROCESS FOR THE PREPARATION OF DRONEDARONE SANOFI (FR) 2013-05-29 EP disclosed
US-20130131358-A1 Novel Process for the Preparation of Dronedarone SANOFI (FR) 2013-05-23 US disclosed
WO-2012010913-A1 NOVEL PROCESS FOR THE PREPARATION OF DRONEDARONE SANOFI (FR) 2012-01-26 WO 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-20130131358-A1 Novel Process for the Preparation of Dronedarone CYP2F1, CYP3A4, CYP2D6 F2 1063/4885F10 512/4885ALOX15 2414/4885

“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.